Vitas-M small molecule compound

6-methoxy-5-nitro-2-(trifluoromethyl)-4H-chromen-4-one

Catalog ID
STK838884
SMILES COc1ccc2c(c1[N+](=O)[O-])c(=O)cc(o2)C(F)(F)F

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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 C11H6F3NO5 MW 289.17 g/mol Purity >90% as per NMR
InChI
InChI=1S/C11H6F3NO5/c1-19-7-3-2-6-9(10(7)15(17)18)5(16)4-8(20-6)11(12,13)14/h2-4H,1H3
InChIKey
WJUILHMXVGFAIS-UHFFFAOYSA-N
Synonyms
342795-08-8
342795088
6methoxy5nitro2(trifluoromethyl)4Hchromen4one
6METHOXY5NITRO2(TRIFLUOROMETHYL)CHROMEN4ONE
COC1=C(C2=C(C=C1)OC(=CC2=O)C(F)(F)F)(N+)(=O)(O)
COc1ccc2c(c1(N+)(=O)(O))c(=O)cc(o2)C(F)(F)F
InChI=1SC11H6F3NO5c11973269(10(7)15(17)18)5(16)48(206)11(1213)14h24H1H3
MFCD02626267
ZINC000000306014
ZINC00306014
ZINC306014

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Available files

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