Vitas-M small molecule compound

methyl 1-(2,2,2-trifluoroethyl)-1H-pyrazole-3-carboxylate

Catalog ID
STL414954
SMILES COC(=O)c1ccn(n1)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 C7H7F3N2O2 MW 208.14 g/mol Purity >90% as per NMR
InChI
InChI=1S/C7H7F3N2O2/c1-14-6(13)5-2-3-12(11-5)4-7(8,9)10/h2-3H,4H2,1H3
InChIKey
XPWPOUHSKSLGLJ-UHFFFAOYSA-N
Synonyms
1245772-13-7
1245772137
COC(=O)C1=NN(C=C1)CC(F)(F)F
InChI=1SC7H7F3N2O2c1146(13)52312(115)47(89)10h23H4H21H3
methyl1(222trifluoroethyl)1Hpyrazole3carboxylate
METHYL1(222TRIFLUOROETHYL)PYRAZOLE3CARBOXYLATE
MFCD18262321
ZINC000072209484
ZINC72209484

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Available files

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