Vitas-M small molecule compound

[4-chloro-3-(trifluoromethyl)-1H-pyrazol-1-yl]acetic acid

Catalog ID
STK349513
SMILES OC(=O)Cn1cc(c(n1)C(F)(F)F)Cl

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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 C6H4ClF3N2O2 MW 228.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H4ClF3N2O2/c7-3-1-12(2-4(13)14)11-5(3)6(8,9)10/h1H,2H2,(H,13,14)
InChIKey
PXOIONIUIBRNGH-UHFFFAOYSA-N
Synonyms
1006446-52-1
(4chloro3(trifluoromethyl)1Hpyrazol1yl)aceticacid
1006446521
2(4CHLORO3(TRIFLUOROMETHYL)1HPYRAZOL1YL)ACETICACID
2(4chloro3(trifluoromethyl)pyrazol1yl)aceticacid
2(4CHLORO3(TRIFLUOROMETHYL)PYRAZOLYL)ACETICACID
C1=C(C(=NN1CC(=O)O)C(F)(F)F)Cl
InChI=1SC6H4ClF3N2O2c73112(24(13)14)115(3)6(89)10h1H2H2(H1314)
MFCD04969232
ZINC000002537059
ZINC2537059

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Available files

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