Vitas-M small molecule compound

3-{[3-(trifluoromethyl)-1H-pyrazol-1-yl]methyl}benzoic acid

Catalog ID
STK349704
SMILES OC(=O)c1cccc(c1)Cn1ccc(n1)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 C12H9F3N2O2 MW 270.21 g/mol Purity >90% as per NMR
InChI
InChI=1S/C12H9F3N2O2/c13-12(14,15)10-4-5-17(16-10)7-8-2-1-3-9(6-8)11(18)19/h1-6H,7H2,(H,18,19)
InChIKey
IYMPJPDKJCWPQM-UHFFFAOYSA-N
Synonyms
1004643-62-2
1004643622
3((3(trifluoromethyl)1Hpyrazol1yl)methyl)benzoicacid
3((3(trifluoromethyl)pyrazol1yl)methyl)benzoicacid
3((3(TRIFLUOROMETHYL)PYRAZOLYL)METHYL)BENZOICACID
3(3TRIFLUOROMETHYLPYRAZOL1YLMETHYL)BENZOICA
3(3TRIFLUOROMETHYLPYRAZOL1YLMETHYL)BENZOICACID
C1=CC(=CC(=C1)CN2C=CC(=N2)C(F)(F)F)C(=O)O
InChI=1SC12H9F3N2O2c1312(1415)104517(1610)782139(68)11(18)19h16H7H2(H1819)
MFCD04970075
ZINC000002537848
ZINC2537848

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Available files

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