| Revision as of 13:43, 15 February 2012 editBeetstra (talk | contribs)Edit filter managers, Administrators172,031 edits Saving copy of the {{chembox}} taken from revid 472114104 of page Creatine_ethyl_ester for the Chem/Drugbox validation project (updated: 'CASNo'). | Latest revision as of 14:02, 8 May 2018 edit Jytdog (talk | contribs)Autopatrolled, Extended confirmed users, Pending changes reviewers, Rollbackers187,951 edits fixTag: Redirect target changed | ||
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| #REDIRECT ] | |||
| {{ambox | text = This page contains a copy of the infobox ({{tl|chembox}}) taken from revid of page ] with values updated to verified values.}} | |||
| {{chembox | |||
| | verifiedrevid = 418337993 | |||
| | ImageFile = creatine ethyl ester.png | |||
| | ImageSize = | |||
| | IUPACName = Ethyl ''N''-(aminoiminomethyl)-''N''-methylglycine | |||
| | OtherNames = | |||
| | Section1 = {{Chembox Identifiers | |||
| | ChemSpiderID_Ref = {{chemspidercite|correct|chemspider}} | |||
| | ChemSpiderID = 8373317 | |||
| | InChI = 1/C6H13N3O2/c1-3-11-5(10)4-9(2)6(7)8/h3-4H2,1-2H3,(H3,7,8) | |||
| | InChIKey = UFUWQSYRGLMLKP-UHFFFAOYAK | |||
| | SMILES1 = O=C(OCC)CN(C(=)N)C | |||
| | StdInChI_Ref = {{stdinchicite|correct|chemspider}} | |||
| | StdInChI = 1S/C6H13N3O2/c1-3-11-5(10)4-9(2)6(7)8/h3-4H2,1-2H3,(H3,7,8) | |||
| | StdInChIKey_Ref = {{stdinchicite|correct|chemspider}} | |||
| | StdInChIKey = UFUWQSYRGLMLKP-UHFFFAOYSA-N | |||
| | CASNo_Ref = {{cascite|correct|??}} | |||
| | CASNo = <!-- blanked - oldvalue: 15366-29-7 --> | |||
| | PubChem = 10197817 | |||
| | SMILES = NC(N(C)CC(OCC)=O)=N | |||
| }} | |||
| | Section2 = {{Chembox Properties | |||
| | Formula = C<sub>6</sub>H<sub>13</sub>N<sub>3</sub>O<sub>2</sub> | |||
| | MolarMass = 159.19 g/mol | |||
| | Appearance = | |||
| | Density = | |||
| | MeltingPt = | |||
| | BoilingPt = | |||
| | Solubility = | |||
| | pKa = 2.67, 11.2, 6 | |||
| }} | |||
| | Section3 = {{Chembox Hazards | |||
| | MainHazards = | |||
| | FlashPt = | |||
| | Autoignition = | |||
| }} | |||
| }} | |||