Organofluorine / Alfa Chemistry
Methyl 2-(3-(trifluoromethyl)phenyl)acetate

Methyl 2-(3-(trifluoromethyl)phenyl)acetate

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Methyl 2-(3-(trifluoromethyl)phenyl)acetate
Catalog OFC62451847-2
CAS 62451-84-7
Category Fluorinated Esters
Purity 97%
MDL Number MFCD04039762
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C10H9F3O2
Molecular Weight 218.17
Molar Refractivity 47.31
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 0.0
Veber 0.0
Consensus LogP 2.99
MLogP 2.99
SILICOS-IT 3.1
WLogP 3.57
XLogP3 2.95
iLogP 2.34
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -5.54 cm/s
P-gp Substrate No
Fraction Csp3 0.3
GHS Pictogram GHS07
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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