Organofluorine / Alfa Chemistry
4-Fluoro-2-(phenylethynyl)benzaldehyde

4-Fluoro-2-(phenylethynyl)benzaldehyde

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4-Fluoro-2-(phenylethynyl)benzaldehyde
Catalog OFC1189207304
CAS 1189207-30-4
Category Fluoroalkynes
Purity 97%
MDL Number MFCD28359714
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C15H9FO
Molecular Weight 224.23
Molar Refractivity 64.21
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 1.0
Veber 0.0
Consensus LogP 3.61
MLogP 3.83
SILICOS-IT 4.49
WLogP 3.54
XLogP3 3.51
iLogP 2.66
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor Yes
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -5.18 cm/s
P-gp Substrate No
Fraction Csp3 0.0
GHS Pictogram GHS07
Hazard Statements H302-H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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