Vitas-M small molecule compound

(2E)-3-(6-nitro-4-oxo-4H-chromen-3-yl)prop-2-enoic acid

Catalog ID
STL328839
SMILES OC(=O)/C=C/c1coc2c(c1=O)cc(cc2)[N+](=O)[O-]

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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 C12H7NO6 MW 261.19 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H7NO6/c14-11(15)4-1-7-6-19-10-3-2-8(13(17)18)5-9(10)12(7)16/h1-6H,(H,14,15)/b4-1+
InChIKey
QFELLHJNFUMHGA-DAFODLJHSA-N
Synonyms

(2E)3(6nitro4oxo4Hchromen3yl)prop2enoicacid
(E)3(6nitro4oxo4Hchromen3yl)acrylicacid
(E)3(6nitro4oxochromen3yl)prop2enoicacid
C1=CC2=C(C=C1(N+)(=O)(O))C(=O)C(=CO2)C=CC(=O)O
InChI=1SC12H7NO6c1411(15)41761910328(13(17)18)59(10)12(7)16h16H(H1415)b41+
MFCD02237062
OC(=O)C=Cc1coc2c(c1=O)cc(cc2)(N+)(=O)(O)
ZINC000006222159
ZINC6222159

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Available files

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