Vitas-M small molecule compound

(5-chloro-2-hydroxyphenyl)[3-(difluoromethyl)-1-methyl-1H-pyrazol-4-yl]methanone

Catalog ID
STK786653
SMILES Clc1ccc(c(c1)C(=O)c1cn(nc1C(F)F)C)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 C12H9ClF2N2O2 MW 286.67 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9ClF2N2O2/c1-17-5-8(10(16-17)12(14)15)11(19)7-4-6(13)2-3-9(7)18/h2-5,12,18H,1H3
InChIKey
HDPYAUVZIDXKDM-UHFFFAOYSA-N
Synonyms
956819-28-6
(5chloro2hydroxyphenyl)(3(difluoromethyl)1methyl1Hpyrazol4yl)methanone
(5chloro2hydroxyphenyl)(3(difluoromethyl)1methylpyrazol4yl)methanone
956819286
CN1C=C(C(=N1)C(F)F)C(=O)C2=C(C=CC(=C2)Cl)O
InChI=1SC12H9ClF2N2O2c11758(10(1617)12(14)15)11(19)746(13)239(7)18h251218H1H3
MFCD08743617
ZINC000012428164
ZINC12428164

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Available files

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