Vitas-M small molecule compound

methyl (2E)-3-(4-nitrophenyl)-2-phenylprop-2-enoate

Catalog ID
STK663970
SMILES COC(=O)/C(=C/c1ccc(cc1)[N+](=O)[O-])/c1ccccc1

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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 C16H13NO4 MW 283.28 g/mol Purity >90% as per NMR
InChI
InChI=1S/C16H13NO4/c1-21-16(18)15(13-5-3-2-4-6-13)11-12-7-9-14(10-8-12)17(19)20/h2-11H,1H3/b15-11+
InChIKey
YKKWDCDQTMQFQI-RVDMUPIBSA-N
Synonyms
42443-21-0
(E)2PHENYL3(4NITROPHENYL)ACRYLICACIDMETHYLESTER
42443210
COC(=O)C(=CC1=CC=C(C=C1)(N+)(=O)(O))C2=CC=CC=C2
COC(=O)C(=Cc1ccc(cc1)(N+)(=O)(O))c1ccccc1
InChI=1SC16H13NO4c12116(18)15(135324613)11127914(10812)17(19)20h211H1H3b1511+
METHYL(2E)3(4NITROPHENYL)2PHENYLACRYLATE
methyl(2E)3(4nitrophenyl)2phenylprop2enoate
METHYL(E)3(4NITROPHENYL)2PHENYLPROP2ENOATE
MFCD03768441
ZINC000000106764
ZINC00106764
ZINC106764

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Available files

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