Organofluorine / Alfa Chemistry
Methyl 3,3,3-trifluoro-2,2-dimethylpropanoate

Methyl 3,3,3-trifluoro-2,2-dimethylpropanoate

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Methyl 3,3,3-trifluoro-2,2-dimethylpropanoate
Catalog OFC1188911729
CAS 1188911-72-9
Category Fluorinated Esters
Purity 97%
MDL Number MFCD18253569
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C6H9F3O2
Molecular Weight 170.13
Molar Refractivity 32.17
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 1.0
Veber 0.0
Consensus LogP 2.11
MLogP 1.79
SILICOS-IT 1.62
WLogP 3.01
XLogP3 2.09
iLogP 2.04
BBB Permeant Yes
CYP1A2 Inhibitor No
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -5.85 cm/s
P-gp Substrate No
Fraction Csp3 0.83
GHS Pictogram GHS07
Hazard Statements H302-H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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