Vitas-M small molecule compound

ethyl (2E)-2-cyano-3-(3-nitrophenyl)prop-2-enoate

Catalog ID
STK391321
SMILES CCOC(=O)/C(=C/c1cccc(c1)[N+](=O)[O-])/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 C12H10N2O4 MW 246.22 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H10N2O4/c1-2-18-12(15)10(8-13)6-9-4-3-5-11(7-9)14(16)17/h3-7H,2H2,1H3/b10-6+
InChIKey
BUEJQBJZGAURKT-UXBLZVDNSA-N
Synonyms
18925-00-3
18925003
2CYANO3(2NITROPHENYL)2PROPENOICACIDETHYLESTER
2CYANO3(3NITROPHENYL)ACRYLICACIDETHYLESTER
3NITROALPHACYANOCINNAMICACIDETHYLESTER
ALPHACYANO3NITROBENZENEACRYLICACIDETHYLESTER
CCOC(=O)C(=CC1=CC(=CC=C1)(N+)(=O)(O))C#N
CCOC(=O)C(=Cc1cccc(c1)(N+)(=O)(O))C#N
ethyl(2E)2cyano3(3nitrophenyl)prop2enoate
ETHYL(E)2CYANO3(3NITROPHENYL)PROP2ENOATE
ETHYL2CYANO2NITROCINNAMATE
ETHYL2CYANO3(3(HYDROXY(OXIDO)AMINO)PHENYL)ACRYLATE
ETHYL2CYANO3(3NITROPHENYL)ACRYLATE
ETHYL2CYANO3(3NITROPHENYL)PROP2ENOATE
InChI=1SC12H10N2O4c121812(15)10(813)6943511(79)14(16)17h37H2H21H3b106+
MFCD00024568
ZINC000000160781
ZINC00160781
ZINC160781

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Available files

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