Vitas-M small molecule compound

methyl (2E)-2-cyano-3-(4-propoxyphenyl)prop-2-enoate

Catalog ID
STK447868
SMILES CCCOc1ccc(cc1)/C=C(/C(=O)OC)\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 C14H15NO3 MW 245.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C14H15NO3/c1-3-8-18-13-6-4-11(5-7-13)9-12(10-15)14(16)17-2/h4-7,9H,3,8H2,1-2H3/b12-9+
InChIKey
SFBZFQKOLXHQTA-FMIVXFBMSA-N
Synonyms

2CYANO3(4PROPOXYPHENYL)PROPENOICACIDMETHYLESTER
4PROPOXYALPHACYANOCINNAMICACIDMETHYLESTER
CCCOC1=CC=C(C=C1)C=C(C#N)C(=O)OC
CCCOc1ccc(cc1)C=C(C(=O)OC)C#N
InChI=1SC14H15NO3c13818136411(5713)912(1015)14(16)172h479H38H212H3b129+
methyl(2E)2cyano3(4propoxyphenyl)prop2enoate
METHYL(E)2CYANO3(4PROPOXYPHENYL)PROP2ENOATE
MFCD00630911
ZINC000003019746
ZINC03019746
ZINC3019746

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Available files

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