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Compounds

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June 16, 2015, at 12:49 PM by 45.56.3.184 -
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!! Chemical Compounds
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December 15, 2010, at 03:43 PM by 158.35.225.229 -
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!!! Retrieve properties via a web query

The following MATLAB script demonstrates the ability to query the APMonitor Thermodynamic Properties via a web query.  The script '''thermo.m''' provides the function call and '''access.m''' is the example script that accesses and displays results.

to:
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!!! Example
Deleted lines 18-28:
[[Attach:access.m.txt | Example script that demonstrates simple queries (access.m)]]
[[Attach:access.m.txt | Thermo function call (thermo.m)]]
(:tableend:)

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!!! Example

(:table border=1 width=50% align=left bgcolor=#EEEEEE cellspacing=0:)
(:cellnr:)
Deleted lines 29-393:
(:cellnr:)
 Chemical compounds in trial software
(:cellnr:)
 Any of the following compounds can be referenced by common
  or IUPAC name, CAS number, or chemical formula
 
 Care should be taken when accessing a compound by formula
  because formula names are not unique and the first
  available match will be selected.
 
 Common Name: methane
 IUPAC Name : methane
 CAS Number : 74-82-8
 Formula    : CH4
 
 Common Name: ethane
 IUPAC Name : ethane
 CAS Number : 74-84-0
 Formula    : C2H6
 
 Common Name: propane
 IUPAC Name : propane
 CAS Number : 74-98-6
 Formula    : C3H8
 
 Common Name: isobutane
 IUPAC Name : isobutane
 CAS Number : 75-28-5
 Formula    : C4H10
 
 Common Name: n-butane
 IUPAC Name : butane
 CAS Number : 106-97-8
 Formula    : C4H10
 
 Common Name: n-pentane
 IUPAC Name : pentane
 CAS Number : 109-66-0
 Formula    : C5H12
 
 Common Name: isopentane
 IUPAC Name : isopentane
 CAS Number : 78-78-4
 Formula    : C5H12
 
 Common Name: neopentane
 IUPAC Name : neopentane
 CAS Number : 463-82-1
 Formula    : C5H12
 
 Common Name: n-hexane
 IUPAC Name : hexane
 CAS Number : 110-54-3
 Formula    : C6H14
 
 Common Name: n-heptane
 IUPAC Name : heptane
 CAS Number : 142-82-5
 Formula    : C7H16
 
 Common Name: n-octane
 IUPAC Name : octane
 CAS Number : 111-65-9
 Formula    : C8H18
 
 Common Name: n-nonane
 IUPAC Name : nonane
 CAS Number : 111-84-2
 Formula    : C9H20
 
 Common Name: squalane
 IUPAC Name : 2,6,10,15,19,23-hexamethyltetracosane
 CAS Number : 111-01-3
 Formula    : C30H62
 
 Common Name: n-decane
 IUPAC Name : decane
 CAS Number : 124-18-5
 Formula    : C10H22
 
 Common Name: n-undecane
 IUPAC Name : undecane
 CAS Number : 1120-21-4
 Formula    : C11H24
 
 Common Name: n-dodecane
 IUPAC Name : dodecane
 CAS Number : 112-40-3
 Formula    : C12H26
 
 Common Name: n-tridecane
 IUPAC Name : tridecane
 CAS Number : 629-50-5
 Formula    : C13H28
 
 Common Name: n-tetradecane
 IUPAC Name : tetradecane
 CAS Number : 629-59-4
 Formula    : C14H30
 
 Common Name: n-pentadecane
 IUPAC Name : pentadecane
 CAS Number : 629-62-9
 Formula    : C15H32
 
 Common Name: n-hexadecane
 IUPAC Name : hexadecane
 CAS Number : 544-76-3
 Formula    : C16H34
 
 Common Name: n-heptadecane
 IUPAC Name : heptadecane
 CAS Number : 629-78-7
 Formula    : C17H36
 
 Common Name: n-octadecane
 IUPAC Name : octadecane
 CAS Number : 593-45-3
 Formula    : C18H38
 
 Common Name: n-nonadecane
 IUPAC Name : nonadecane
 CAS Number : 629-92-5
 Formula    : C19H40
 
 Common Name: n-eicosane
 IUPAC Name : eicosane
 CAS Number : 112-95-8
 Formula    : C20H42
 
 Common Name: cyclopropane
 IUPAC Name : cyclopropane
 CAS Number : 75-19-4
 Formula    : C3H6
 
 Common Name: cyclobutane
 IUPAC Name : cyclobutane
 CAS Number : 287-23-0
 Formula    : C4H8
 
 Common Name: cyclopentane
 IUPAC Name : cyclopentane
 CAS Number : 287-92-3
 Formula    : C5H10
 
 Common Name: cyclohexane
 IUPAC Name : cyclohexane
 CAS Number : 110-82-7
 Formula    : C6H12
 
 Common Name: cycloheptane
 IUPAC Name : cycloheptane
 CAS Number : 291-64-5
 Formula    : C7H14
 
 Common Name: cyclooctane
 IUPAC Name : cyclooctane
 CAS Number : 292-64-8
 Formula    : C8H16
 
 Common Name: ethylene
 IUPAC Name : ethylene
 CAS Number : 74-85-1
 Formula    : C2H4
 
 Common Name: propylene
 IUPAC Name : propylene
 CAS Number : 115-07-1
 Formula    : C3H6
 
 Common Name: 1-butene
 IUPAC Name : 1-butene
 CAS Number : 106-98-9
 Formula    : C4H8
 
 Common Name: isobutene
 IUPAC Name : isobutene
 CAS Number : 115-11-7
 Formula    : C4H8
 
 Common Name: 1-pentene
 IUPAC Name : 1-pentene
 CAS Number : 109-67-1
 Formula    : C5H10
 
 Common Name: 1-hexene
 IUPAC Name : 1-hexene
 CAS Number : 592-41-6
 Formula    : C6H12
 
 Common Name: 1-heptene
 IUPAC Name : 1-heptene
 CAS Number : 592-76-7
 Formula    : C7H14
 
 Common Name: 1-octene
 IUPAC Name : 1-octene
 CAS Number : 111-66-0
 Formula    : C8H16
 
 Common Name: 1-nonene
 IUPAC Name : 1-nonene
 CAS Number : 124-11-8
 Formula    : C9H18
 
 Common Name: 1-decene
 IUPAC Name : 1-decene
 CAS Number : 872-05-9
 Formula    : C10H20
 
 Common Name: 1-undecene
 IUPAC Name : 1-undecene
 CAS Number : 821-95-4
 Formula    : C11H22
 
 Common Name: 1-dodecene
 IUPAC Name : 1-dodecene
 CAS Number : 112-41-4
 Formula    : C12H24
 
 Common Name: 1-tridecene
 IUPAC Name : 1-tridecene
 CAS Number : 2437-56-1
 Formula    : C13H26
 
 Common Name: 1-tetradecene
 IUPAC Name : 1-tetradecene
 CAS Number : 1120-36-1
 Formula    : C14H28
 
 Common Name: 1-pentadecene
 IUPAC Name : 1-pentadecene
 CAS Number : 13360-61-7
 Formula    : C15H30
 
 Common Name: 1-hexadecene
 IUPAC Name : 1-hexadecene
 CAS Number : 629-73-2
 Formula    : C16H32
 
 Common Name: 1-octadecene
 IUPAC Name : 1-octadecene
 CAS Number : 112-88-9
 Formula    : C18H36
 
 Common Name: cyclopentene
 IUPAC Name : cyclopentene
 CAS Number : 142-29-0
 Formula    : C5H8
 
 Common Name: cyclohexene
 IUPAC Name : cyclohexene
 CAS Number : 110-83-8
 Formula    : C6H10
 
 Common Name: isoprene
 IUPAC Name : isoprene
 CAS Number : 78-79-5
 Formula    : C5H8
 
 Common Name: benzene
 IUPAC Name : benzene
 CAS Number : 71-43-2
 Formula    : C6H6
 
 Common Name: toluene
 IUPAC Name : toluene
 CAS Number : 108-88-3
 Formula    : C7H8
 
 Common Name: ethylbenzene
 IUPAC Name : ethylbenzene
 CAS Number : 100-41-4
 Formula    : C8H10
 
 Common Name: o-xylene
 IUPAC Name : 1,2-dimethylbenzene
 CAS Number : 95-47-6
 Formula    : C8H10
 
 Common Name: m-xylene
 IUPAC Name : 1,3-dimethylbenzene
 CAS Number : 108-38-3
 Formula    : C8H10
 
 Common Name: p-xylene
 IUPAC Name : 1,4-dimethylbenzene
 CAS Number : 106-42-3
 Formula    : C8H10
 
 Common Name: styrene
 IUPAC Name : phenylethene
 CAS Number : 100-42-5
 Formula    : C8H8
 
 Common Name: oxygen
 IUPAC Name : oxygen
 CAS Number : 7782-44-7
 Formula    : O2
 
 Common Name: hydrogen
 IUPAC Name : hydrogen
 CAS Number : 1333-74-0
 Formula    : H2
 
 Common Name: nitrogen
 IUPAC Name : nitrogen
 CAS Number : 7727-37-9
 Formula    : N2
 
 Common Name: carbon monoxide
 IUPAC Name : carbon monoxide
 CAS Number : 630-08-0
 Formula    : CO
 
 Common Name: carbon dioxide
 IUPAC Name : carbon dioxide
 CAS Number : 124-38-9
 Formula    : CO2
 
 Common Name: air
 IUPAC Name : air
 CAS Number : 132259-10-0
 Formula    : MIXTURE
 
 Common Name: acetone
 IUPAC Name : acetone
 CAS Number : 67-64-1
 Formula    : C3H6O
 
 Common Name: methanol
 IUPAC Name : methanol
 CAS Number : 67-56-1
 Formula    : CH4O
 
 Common Name: ethanol
 IUPAC Name : ethanol
 CAS Number : 64-17-5
 Formula    : C2H6O
 
 Common Name: vinyl acetate
 IUPAC Name : vinyl acetate
 CAS Number : 108-05-4
 Formula    : C4H6O2
 
 Common Name: ammonia
 IUPAC Name : ammonia
 CAS Number : 7664-41-7
 Formula    : H3N
 
 Common Name: sodium hydroxide
 IUPAC Name : sodium hydroxide
 CAS Number : 1310-73-2
 Formula    : HNaO
 
 Common Name: water
 IUPAC Name : water
 CAS Number : 7732-18-5
 Formula    : H2O

 Common Name: hydrogen sulfide
 IUPAC Name : hydrogen sulfide
 CAS Number : 7783-06-4
 Formula    : H2S

December 15, 2010, at 03:41 PM by 158.35.225.229 -
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[[Attach:access.m | Example script that demonstrates simple queries (access.m)]]
[[Attach:access.m | Thermo function call (thermo.m)]]
to:
[[Attach:access.m.txt | Example script that demonstrates simple queries (access.m)]]
[[Attach:access.m.txt | Thermo function call (thermo.m)]]
Added lines 22-23:

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December 15, 2010, at 03:40 PM by 158.35.225.229 -
Added lines 12-22:

!!! Retrieve properties via a web query

The following MATLAB script demonstrates the ability to query the APMonitor Thermodynamic Properties via a web query.  The script '''thermo.m''' provides the function call and '''access.m''' is the example script that accesses and displays results.

(:table border=1 width=50% align=left bgcolor=#EEEEEE cellspacing=0:)
(:cellnr:)
[[Attach:access.m | Example script that demonstrates simple queries (access.m)]]
[[Attach:access.m | Thermo function call (thermo.m)]]
(:tableend:)

December 15, 2010, at 03:29 PM by 158.35.225.229 -
Changed line 3 from:
The chemical compounds used in the flowsheet are defined in the ''Compounds ... End Compounds'' section.  There are more than 1700 compounds available in the thermodynamic database.  If the chemical compound is not available, a text file named ''compounds.txt'' is generated when the problem solution is attempted.  There are 71 commonly used compounds that are available by default in the trial version of the software.
to:
The chemical compounds used in the flowsheet are defined in the ''Compounds ... End Compounds'' section.  There are more than 1700 compounds available in the thermodynamic database.  If the chemical compound is not available, a text file named ''compounds.txt'' is generated when the problem solution is attempted.  There are commonly used compounds that are available by default in the trial version of the software.
December 15, 2010, at 01:08 PM by 158.35.225.229 -
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[[http://www.apmonitor.com/thermo/ | Thermodynamic Properties Available in APMonitor]]
November 03, 2008, at 08:16 AM by 158.35.225.228 -
Added lines 385-389:

 Common Name: hydrogen sulfide
 IUPAC Name : hydrogen sulfide
 CAS Number : 7783-06-4
 Formula    : H2S
September 30, 2008, at 09:44 AM by 158.35.225.227 -
Added lines 4-5:

When only one compound is selected, the modeling system automatically creates a duplicate compound of the same type.  This is used to simplify the management of modeling equations that are valid for 2 or greater number of compounds.
September 26, 2008, at 03:27 PM by 158.35.225.231 -
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(:tableend:)


----

!!!
Chemical compounds in trial software

(:table border=1 width=50% align=left bgcolor=#EEEEEE cellspacing=0:)
to:
(:cellnr:)
 Chemical compounds in trial software
September 26, 2008, at 03:26 PM by 158.35.225.231 -
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September 26, 2008, at 03:26 PM by 158.35.225.231 -
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!!! Example
Changed line 27 from:
* Chemical compounds in the trial version of the software.
to:
!!! Chemical compounds in trial software
September 26, 2008, at 03:25 PM by 158.35.225.231 -
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 Chemical compounds in the trial version of the software.
to:
 ! Example compounds section
 Model heat_exchanger
  Compounds
    water
    air
  End Compounds

  Objects
    exchanger As Vessel
  End Objects
 End Model
(:tableend:)


* Chemical compounds in the trial version of the
software.

(:table border=1 width=50% align=left bgcolor=#EEEEEE cellspacing=0:)
September 26, 2008, at 03:22 PM by 158.35.225.231 -
Added lines 1-370:
!! Chemical Compounds

The chemical compounds used in the flowsheet are defined in the ''Compounds ... End Compounds'' section.  There are more than 1700 compounds available in the thermodynamic database.  If the chemical compound is not available, a text file named ''compounds.txt'' is generated when the problem solution is attempted.  There are 71 commonly used compounds that are available by default in the trial version of the software.

!!! Compounds in the Object Library

The object library consists of chemical processing equipment such as feed streams, reactors, pumps, mixers, flash columns, vessels, and distillation stages.  The compounds section is used to define the number, type, and order of chemical species in a stream or vessel.

(:table border=1 width=50% align=left bgcolor=#EEEEEE cellspacing=0:)
(:cellnr:)
 Chemical compounds in the trial version of the software.
(:cellnr:)
 Any of the following compounds can be referenced by common
  or IUPAC name, CAS number, or chemical formula
 
 Care should be taken when accessing a compound by formula
  because formula names are not unique and the first
  available match will be selected.
 
 Common Name: methane
 IUPAC Name : methane
 CAS Number : 74-82-8
 Formula    : CH4
 
 Common Name: ethane
 IUPAC Name : ethane
 CAS Number : 74-84-0
 Formula    : C2H6
 
 Common Name: propane
 IUPAC Name : propane
 CAS Number : 74-98-6
 Formula    : C3H8
 
 Common Name: isobutane
 IUPAC Name : isobutane
 CAS Number : 75-28-5
 Formula    : C4H10
 
 Common Name: n-butane
 IUPAC Name : butane
 CAS Number : 106-97-8
 Formula    : C4H10
 
 Common Name: n-pentane
 IUPAC Name : pentane
 CAS Number : 109-66-0
 Formula    : C5H12
 
 Common Name: isopentane
 IUPAC Name : isopentane
 CAS Number : 78-78-4
 Formula    : C5H12
 
 Common Name: neopentane
 IUPAC Name : neopentane
 CAS Number : 463-82-1
 Formula    : C5H12
 
 Common Name: n-hexane
 IUPAC Name : hexane
 CAS Number : 110-54-3
 Formula    : C6H14
 
 Common Name: n-heptane
 IUPAC Name : heptane
 CAS Number : 142-82-5
 Formula    : C7H16
 
 Common Name: n-octane
 IUPAC Name : octane
 CAS Number : 111-65-9
 Formula    : C8H18
 
 Common Name: n-nonane
 IUPAC Name : nonane
 CAS Number : 111-84-2
 Formula    : C9H20
 
 Common Name: squalane
 IUPAC Name : 2,6,10,15,19,23-hexamethyltetracosane
 CAS Number : 111-01-3
 Formula    : C30H62
 
 Common Name: n-decane
 IUPAC Name : decane
 CAS Number : 124-18-5
 Formula    : C10H22
 
 Common Name: n-undecane
 IUPAC Name : undecane
 CAS Number : 1120-21-4
 Formula    : C11H24
 
 Common Name: n-dodecane
 IUPAC Name : dodecane
 CAS Number : 112-40-3
 Formula    : C12H26
 
 Common Name: n-tridecane
 IUPAC Name : tridecane
 CAS Number : 629-50-5
 Formula    : C13H28
 
 Common Name: n-tetradecane
 IUPAC Name : tetradecane
 CAS Number : 629-59-4
 Formula    : C14H30
 
 Common Name: n-pentadecane
 IUPAC Name : pentadecane
 CAS Number : 629-62-9
 Formula    : C15H32
 
 Common Name: n-hexadecane
 IUPAC Name : hexadecane
 CAS Number : 544-76-3
 Formula    : C16H34
 
 Common Name: n-heptadecane
 IUPAC Name : heptadecane
 CAS Number : 629-78-7
 Formula    : C17H36
 
 Common Name: n-octadecane
 IUPAC Name : octadecane
 CAS Number : 593-45-3
 Formula    : C18H38
 
 Common Name: n-nonadecane
 IUPAC Name : nonadecane
 CAS Number : 629-92-5
 Formula    : C19H40
 
 Common Name: n-eicosane
 IUPAC Name : eicosane
 CAS Number : 112-95-8
 Formula    : C20H42
 
 Common Name: cyclopropane
 IUPAC Name : cyclopropane
 CAS Number : 75-19-4
 Formula    : C3H6
 
 Common Name: cyclobutane
 IUPAC Name : cyclobutane
 CAS Number : 287-23-0
 Formula    : C4H8
 
 Common Name: cyclopentane
 IUPAC Name : cyclopentane
 CAS Number : 287-92-3
 Formula    : C5H10
 
 Common Name: cyclohexane
 IUPAC Name : cyclohexane
 CAS Number : 110-82-7
 Formula    : C6H12
 
 Common Name: cycloheptane
 IUPAC Name : cycloheptane
 CAS Number : 291-64-5
 Formula    : C7H14
 
 Common Name: cyclooctane
 IUPAC Name : cyclooctane
 CAS Number : 292-64-8
 Formula    : C8H16
 
 Common Name: ethylene
 IUPAC Name : ethylene
 CAS Number : 74-85-1
 Formula    : C2H4
 
 Common Name: propylene
 IUPAC Name : propylene
 CAS Number : 115-07-1
 Formula    : C3H6
 
 Common Name: 1-butene
 IUPAC Name : 1-butene
 CAS Number : 106-98-9
 Formula    : C4H8
 
 Common Name: isobutene
 IUPAC Name : isobutene
 CAS Number : 115-11-7
 Formula    : C4H8
 
 Common Name: 1-pentene
 IUPAC Name : 1-pentene
 CAS Number : 109-67-1
 Formula    : C5H10
 
 Common Name: 1-hexene
 IUPAC Name : 1-hexene
 CAS Number : 592-41-6
 Formula    : C6H12
 
 Common Name: 1-heptene
 IUPAC Name : 1-heptene
 CAS Number : 592-76-7
 Formula    : C7H14
 
 Common Name: 1-octene
 IUPAC Name : 1-octene
 CAS Number : 111-66-0
 Formula    : C8H16
 
 Common Name: 1-nonene
 IUPAC Name : 1-nonene
 CAS Number : 124-11-8
 Formula    : C9H18
 
 Common Name: 1-decene
 IUPAC Name : 1-decene
 CAS Number : 872-05-9
 Formula    : C10H20
 
 Common Name: 1-undecene
 IUPAC Name : 1-undecene
 CAS Number : 821-95-4
 Formula    : C11H22
 
 Common Name: 1-dodecene
 IUPAC Name : 1-dodecene
 CAS Number : 112-41-4
 Formula    : C12H24
 
 Common Name: 1-tridecene
 IUPAC Name : 1-tridecene
 CAS Number : 2437-56-1
 Formula    : C13H26
 
 Common Name: 1-tetradecene
 IUPAC Name : 1-tetradecene
 CAS Number : 1120-36-1
 Formula    : C14H28
 
 Common Name: 1-pentadecene
 IUPAC Name : 1-pentadecene
 CAS Number : 13360-61-7
 Formula    : C15H30
 
 Common Name: 1-hexadecene
 IUPAC Name : 1-hexadecene
 CAS Number : 629-73-2
 Formula    : C16H32
 
 Common Name: 1-octadecene
 IUPAC Name : 1-octadecene
 CAS Number : 112-88-9
 Formula    : C18H36
 
 Common Name: cyclopentene
 IUPAC Name : cyclopentene
 CAS Number : 142-29-0
 Formula    : C5H8
 
 Common Name: cyclohexene
 IUPAC Name : cyclohexene
 CAS Number : 110-83-8
 Formula    : C6H10
 
 Common Name: isoprene
 IUPAC Name : isoprene
 CAS Number : 78-79-5
 Formula    : C5H8
 
 Common Name: benzene
 IUPAC Name : benzene
 CAS Number : 71-43-2
 Formula    : C6H6
 
 Common Name: toluene
 IUPAC Name : toluene
 CAS Number : 108-88-3
 Formula    : C7H8
 
 Common Name: ethylbenzene
 IUPAC Name : ethylbenzene
 CAS Number : 100-41-4
 Formula    : C8H10
 
 Common Name: o-xylene
 IUPAC Name : 1,2-dimethylbenzene
 CAS Number : 95-47-6
 Formula    : C8H10
 
 Common Name: m-xylene
 IUPAC Name : 1,3-dimethylbenzene
 CAS Number : 108-38-3
 Formula    : C8H10
 
 Common Name: p-xylene
 IUPAC Name : 1,4-dimethylbenzene
 CAS Number : 106-42-3
 Formula    : C8H10
 
 Common Name: styrene
 IUPAC Name : phenylethene
 CAS Number : 100-42-5
 Formula    : C8H8
 
 Common Name: oxygen
 IUPAC Name : oxygen
 CAS Number : 7782-44-7
 Formula    : O2
 
 Common Name: hydrogen
 IUPAC Name : hydrogen
 CAS Number : 1333-74-0
 Formula    : H2
 
 Common Name: nitrogen
 IUPAC Name : nitrogen
 CAS Number : 7727-37-9
 Formula    : N2
 
 Common Name: carbon monoxide
 IUPAC Name : carbon monoxide
 CAS Number : 630-08-0
 Formula    : CO
 
 Common Name: carbon dioxide
 IUPAC Name : carbon dioxide
 CAS Number : 124-38-9
 Formula    : CO2
 
 Common Name: air
 IUPAC Name : air
 CAS Number : 132259-10-0
 Formula    : MIXTURE
 
 Common Name: acetone
 IUPAC Name : acetone
 CAS Number : 67-64-1
 Formula    : C3H6O
 
 Common Name: methanol
 IUPAC Name : methanol
 CAS Number : 67-56-1
 Formula    : CH4O
 
 Common Name: ethanol
 IUPAC Name : ethanol
 CAS Number : 64-17-5
 Formula    : C2H6O
 
 Common Name: vinyl acetate
 IUPAC Name : vinyl acetate
 CAS Number : 108-05-4
 Formula    : C4H6O2
 
 Common Name: ammonia
 IUPAC Name : ammonia
 CAS Number : 7664-41-7
 Formula    : H3N
 
 Common Name: sodium hydroxide
 IUPAC Name : sodium hydroxide
 CAS Number : 1310-73-2
 Formula    : HNaO
 
 Common Name: water
 IUPAC Name : water
 CAS Number : 7732-18-5
 Formula    : H2O

(:tableend:)