Vitas-M small molecule compound
cyclopropyl[3-hydroxy-3-(trifluoromethyl)-3a,4,5,6,7,8-hexahydrocyclohepta[c]pyrazol-2(3H)-yl]methanone
Catalog ID
STK053227
SMILES O=C(N1N=C2C(C1(O)C(F)(F)F)CCCCC2)C1CC1
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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 C13H17F3N2O2 MW 290.29 g/mol Purity >90% as per NMR
InChI
InChI=1S/C13H17F3N2O2/c14-13(15,16)12(20)9-4-2-1-3-5-10(9)17-18(12)11(19)8-6-7-8/h8-9,20H,1-7H2InChIKey
QLNFGMNXRWMNKL-UHFFFAOYSA-NSynonyms
C1CCC2C(=NN(C2(C(F)(F)F)O)C(=O)C3CC3)CC1
cyclopropyl(3hydroxy3(trifluoromethyl)3a45678hexahydrocyclohepta(c)pyrazol2(3H)yl)methanone
cyclopropyl(3hydroxy3(trifluoromethyl)3a45678hexahydrocyclohepta(c)pyrazol2yl)methanone
InChI=1SC13H17F3N2O2c1413(1516)12(20)94213510(9)1718(12)11(19)8678h8920H17H2
MFCD02911542
O=C(N1N=C2C(C1(O)C(F)(F)F)CCCCC2)C1CC1
STK053227
ZINC000000912177
ZINC000004265649
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