Organofluorine / Alfa Chemistry
1-(2-Amino-5-chlorophenyl)-2,2,2-trifluoroethanone hydrochloride

1-(2-Amino-5-chlorophenyl)-2,2,2-trifluoroethanone hydrochloride

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1-(2-Amino-5-chlorophenyl)-2,2,2-trifluoroethanone hydrochloride
Catalog OFC173676590-2
CAS 173676-59-0
Category Fluorinated Ketones
Purity 97%
MDL Number MFCD09263480
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Chemical Data Computational Chemistry
Molecular Formula C8H6Cl2F3NO
Molecular Weight 260.04
Molar Refractivity 53.21
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 0.0
Veber 0.0
Consensus LogP 2.77
MLogP 2.44
SILICOS-IT 2.67
WLogP 4.74
XLogP3 4.02
iLogP 0.0
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -5.03 cm/s
P-gp Substrate No
Fraction Csp3 0.12

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