Vitas-M small molecule compound

ethyl (2E)-3-(1,3-benzodioxol-5-yl)-2-cyanoprop-2-enoate

Catalog ID
STK392837
SMILES CCOC(=O)/C(=C/c1ccc2c(c1)OCO2)/C#N

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C13H11NO4 MW 245.23 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H11NO4/c1-2-16-13(15)10(7-14)5-9-3-4-11-12(6-9)18-8-17-11/h3-6H,2,8H2,1H3/b10-5+
InChIKey
RYGTWDAUOUMNRA-BJMVGYQFSA-N
Synonyms
2286-56-8
(E)ALPHACYANO13BENZODIOXOLE5ACRYLICACIDETHYLESTER
(E)ETHYL3(BENZO(D)(13)DIOXOL5YL)2CYANOACRYLATE
2286568
2PROPENOICACID3(13BENZODIOXOL5YL)2CYANOETHYLESTER
2PROPENOICACID3(13BENZODIOXOL5YL)2CYANOETHYLESTER(2E)
2PROPENOICACID3(13BENZODIOXOL5YL)2CYANOETHYLESTER(9CI)
2PROPENOICACID3BENZODIOXOL5YL)2CYANOETHYLESTER
3BENZO(13)DIOXOL5YL2CYANOACRYLICACIDETHYLESTER
ALPHACYANO13BENZODIOXOLE5ACRYLICACIDETHYLESTER
ALPHACYANO34METHYLENEDIOXYCINNAMICACIDETHYLESTER
CCOC(=O)C(=CC1=CC2=C(C=C1)OCO2)C#N
CCOC(=O)C(=Cc1ccc2c(c1)OCO2)C#N
CINNAMICACID4METHYLENEDIOXYETHYLESTER
CINNAMICACIDALPHACYANO34METHYLENEDIOXYETHYLESTER
ETHYL(2E)3(13BENZODIOXOL5YL)2CYANO2PROPENOATE
ETHYL(2E)3(13BENZODIOXOL5YL)2CYANOACRYLATE
ethyl(2E)3(13benzodioxol5yl)2cyanoprop2enoate
ETHYL(2E)3(2H13BENZODIOXOL5YL)2CYANOPROP2ENOATE
ETHYL(2E)3(2HBENZO(34D)13DIOXOLEN5YL)2CYANOPROP2ENOATE
ETHYL(E)3(13BENZODIOXOL5YL)2CYANOPROP2ENOATE
ETHYL3(13BENZODIOXOL5YL)2CYANOACRYLATE
ETHYL3(13BENZODIOXOL5YL)2CYANOPROP2ENOATE
ETHYL3(2H13BENZODIOXOL5YL)2CYANOPROP2ENOATE
ETHYL3(BENZO(D)(13)DIOXOL5YL)2CYANOACRYLATE
ETHYLALPHACYANO34METHYLENEDIOXYCINNAMATE
ETHYLALPHACYANOBETA(34METHYLENEDIOXYPHENYL)ACRYLATE
ETHYLBENZODIOXOLYLCYANOACRYLATE
InChI=1SC13H11NO4c121613(15)10(714)59341112(69)1881711h36H28H21H3b105+
MFCD00022988
ZINC000000121514
ZINC00121514
ZINC121514

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Available files

Download the SDF, MOL, 3D structure and SDS documents from Vitas-M.