Vitas-M small molecule compound
4-chloro-1-(2,2,2-trifluoroethyl)-1H-pyrazole-3-carboxylic acid
Catalog ID
STL414433
SMILES OC(=O)c1nn(cc1Cl)CC(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 C6H4ClF3N2O2 MW 228.56 g/mol Purity >90% as per NMR
InChI
InChI=1S/C6H4ClF3N2O2/c7-3-1-12(2-6(8,9)10)11-4(3)5(13)14/h1H,2H2,(H,13,14)InChIKey
XNUPYEQBUFJBPP-UHFFFAOYSA-NSynonyms
1006448-63-01006448630
1HPYRAZOLE3CARBOXYLICACID4CHLORO1(222TRIFLUOROETHYL)
4CHLORO1(222TRIFLUOROETHYL)1HPYRAZOLE3
4chloro1(222trifluoroethyl)1Hpyrazole3carboxylicacid
4CHLORO1(222TRIFLUOROETHYL)PYRAZOLE3CARBOXYLICACID
C1=C(C(=NN1CC(F)(F)F)C(=O)O)Cl
InChI=1SC6H4ClF3N2O2c73112(26(89)10)114(3)5(13)14h1H2H2(H1314)
MFCD08696331
ZINC000013747843
ZINC13747843
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