Organofluorine / Alfa Chemistry
Methyl 3-(trifluoromethyl)-1H-pyrazole-4-carboxylate

Methyl 3-(trifluoromethyl)-1H-pyrazole-4-carboxylate

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Methyl 3-(trifluoromethyl)-1H-pyrazole-4-carboxylate
Catalog OFC61859969
CAS 61859-96-9
Category Fluorinated Esters
Purity 95%
MDL Number MFCD13151914
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C6H5F3N2O2
Molecular Weight 194.11
Molar Refractivity 34.87
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 1.0
Veber 0.0
Consensus LogP 1.43
MLogP 0.77
SILICOS-IT 1.88
WLogP 2.37
XLogP3 0.99
iLogP 1.14
BBB Permeant Yes
CYP1A2 Inhibitor No
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -6.78 cm/s
P-gp Substrate No
Fraction Csp3 0.33
GHS Pictogram GHS07
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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