Vitas-M small molecule compound
tert-butyl 5-hydroxy-3-(2-methylpropyl)-5-(trifluoromethyl)-4,5-dihydro-1H-pyrazole-1-carboxylate
Catalog ID
STK061412
SMILES CC(CC1=NN(C(C1)(O)C(F)(F)F)C(=O)OC(C)(C)C)C
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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 C13H21F3N2O3 MW 310.32 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H21F3N2O3/c1-8(2)6-9-7-12(20,13(14,15)16)18(17-9)10(19)21-11(3,4)5/h8,20H,6-7H2,1-5H3InChIKey
MCIOVEGBMDPCAW-UHFFFAOYSA-NSynonyms
CC(C)CC1=NN(C(C1)(C(F)(F)F)O)C(=O)OC(C)(C)C
CC(CC1=NN(C(C1)(O)C(F)(F)F)C(=O)OC(C)(C)C)C
InChI=1SC13H21F3N2O3c18(2)69712(2013(1415)16)18(179)10(19)2111(34)5h820H67H215H3
MFCD02214189
STK061412
TERTBUTYL5HYDROXY3(2METHYLPROPYL)5(TRIFLUOROMETHYL)45DIHYDRO1HPYRAZOLE1CARBOXYLATE
TERTBUTYL5HYDROXY3(2METHYLPROPYL)5(TRIFLUOROMETHYL)4HPYRAZOLE1CARBOXYLATE
ZINC000000270164
ZINC000000270169
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