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Revision as of 04:46, 17 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 463262455 of page Allyl_acetate for the Chem/Drugbox validation project (updated: '').← Previous edit Revision as of 04:46, 17 February 2012 edit undoBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 475318953 of page Allura_Red_AC for the Chem/Drugbox validation project (updated: '').Next edit →
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{{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}} {{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}}
{{chembox {{chembox
| verifiedrevid = 387693830 | verifiedrevid = 454148548
| ImageFile = Allyl acetate.png |ImageFile=Allura Red AC.png
|IUPACName=disodium 6-hydroxy-5-((2-methoxy-5-methyl-4-sulfophenyl)azo)-2-naphthalenesulfonate
| ImageSize = 200px
|OtherNames=Allura Red, Food Red 17, C.I. 16035, FD&C Red 40, E129, 2-naphthalenesulfonic acid disodium salt
| IUPACName = 2-Propenyl acetate
⚫ |Section1= {{Chembox Identifiers
| SystematicName =
| UNII_Ref = {{fdacite|correct|FDA}}
| OtherNames =
| UNII = WZB9127XOA
⚫ | Section1 = {{Chembox Identifiers
| InChI = 1/C18H16N2O8S2.2Na/c1-10-7-14(16(28-2)9-17(10)30(25,26)27)19-20-18-13-5-4-12(29(22,23)24)8-11(13)3-6-15(18)21;;/h3-9,21H,1-2H3,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2/b20-19+;;
| SMILES = C=CCOC(C)=O
| InChIKey = CEZCCHQBSQPRMU-JGGVBICHBN
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
| StdInChI_Ref = {{stdinchicite|correct|chemspider}}
⚫ | ChemSpiderID = 11096
| StdInChI = 1S/C18H16N2O8S2.2Na/c1-10-7-14(16(28-2)9-17(10)30(25,26)27)19-20-18-13-5-4-12(29(22,23)24)8-11(13)3-6-15(18)21;;/h3-9,21H,1-2H3,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2/b20-19+;;
⚫ | CASNo_Ref = {{cascite}}
| StdInChIKey_Ref = {{stdinchicite|correct|chemspider}}
⚫ | CASNo = 591-87-7
| StdInChIKey = CEZCCHQBSQPRMU-LLIZZRELSA-L
⚫ | PubChem =
⚫ | CASNo_Ref = {{cascite|correct|CAS}}
⚫ | CASNo=25956-17-6
| EINECS=
⚫ | PubChem=6093299
| SMILES = ..COc3cc(c(C)cc3/N=N/c1c2ccc(cc2ccc1O)S()(=O)=O)S()(=O)=O
⚫ | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}}
⚫ | ChemSpiderID=11588224
}} }}
| Section2 = {{Chembox Properties |Section2= {{Chembox Properties
| C=5|H=8|O=2 | C=18 | H=14 | N=2 | Na=2| O=8 | S=2
| Appearance = Colorless liquid | Appearance= red powder
| Density = 0.928 g/cm<sup>3</sup> | Density=
| MeltingPtC = | MeltingPt= >300°C
| BoilingPt=
| BoilingPtC = 103
| Solubility=
}} }}
| Section7 = {{Chembox Hazards |Section3= {{Chembox Hazards
| ExternalMSDS = | MainHazards=
| NFPA-H = | FlashPt=
| NFPA-R = | Autoignition=
| NFPA-F =
| RPhrases = {{R11}} {{R21}} {{R23}} {{R25}} {{R36}}
| SPhrases = {{S16}} {{S26}} {{S45}} {{S36}}
| FlashPt =
| ExploLimits =
| Autoignition =
}} }}
}} }}

Revision as of 04:46, 17 February 2012

This page contains a copy of the infobox ({{chembox}}) taken from revid 475318953 of page Allura_Red_AC with values updated to verified values.
WikiProject Chemicals/Chembox validation/VerifiedDataSandbox
Names
IUPAC name disodium 6-hydroxy-5-((2-methoxy-5-methyl-4-sulfophenyl)azo)-2-naphthalenesulfonate
Other names Allura Red, Food Red 17, C.I. 16035, FD&C Red 40, E129, 2-naphthalenesulfonic acid disodium salt
Identifiers
CAS Number
3D model (JSmol)
ChemSpider
PubChem CID
UNII
InChI
  • InChI=1S/C18H16N2O8S2.2Na/c1-10-7-14(16(28-2)9-17(10)30(25,26)27)19-20-18-13-5-4-12(29(22,23)24)8-11(13)3-6-15(18)21;;/h3-9,21H,1-2H3,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2/b20-19+;;Key: CEZCCHQBSQPRMU-LLIZZRELSA-L
  • InChI=1/C18H16N2O8S2.2Na/c1-10-7-14(16(28-2)9-17(10)30(25,26)27)19-20-18-13-5-4-12(29(22,23)24)8-11(13)3-6-15(18)21;;/h3-9,21H,1-2H3,(H,22,23,24)(H,25,26,27);;/q;2*+1/p-2/b20-19+;;Key: CEZCCHQBSQPRMU-JGGVBICHBN
SMILES
  • ..COc3cc(c(C)cc3/N=N/c1c2ccc(cc2ccc1O)S()(=O)=O)S()(=O)=O
Properties
Chemical formula C18H14N2Na2O8S2
Molar mass 496.42 g·mol
Appearance red powder
Melting point >300°C
Except where otherwise noted, data are given for materials in their standard state (at 25 °C , 100 kPa). checkY verify (what is  ?) Infobox references
Chemical compound