Organofluorine / Alfa Chemistry
2-Ethoxy-6-fluorobenzonitrile

2-Ethoxy-6-fluorobenzonitrile

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2-Ethoxy-6-fluorobenzonitrile
Catalog OFC119584735
CAS 119584-73-5
Category Fluorinated Nitriles
Purity 96%
MDL Number MFCD05664780
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C9H8FNO
Molecular Weight 165.16
Molar Refractivity 42.41
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 1.0
Veber 0.0
Consensus LogP 2.22
MLogP 1.86
SILICOS-IT 2.55
WLogP 2.52
XLogP3 2.08
iLogP 2.11
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -5.83 cm/s
P-gp Substrate No
Fraction Csp3 0.22
GHS Pictogram GHS07
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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