Organofluorine / Alfa Chemistry
2-Chloro-4-(trifluoromethyl)benzaldehyde

2-Chloro-4-(trifluoromethyl)benzaldehyde

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2-Chloro-4-(trifluoromethyl)benzaldehyde
Catalog OFC82096911
CAS 82096-91-1
Category Fluorinated Aldehydes
Purity 96%
MDL Number MFCD04112538
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Chemical Data Computational Chemistry Health Safety
Molecular Formula C8H4ClF3O
Molecular Weight 208.57
Molar Refractivity 41.84
Bioavailability Score 0.55
Egan 0.0
Ghose None
Lipinski 0.0
Muegge 1.0
Veber 0.0
Consensus LogP 3.17
MLogP 3.08
SILICOS-IT 3.65
WLogP 4.32
XLogP3 2.9
iLogP 1.88
BBB Permeant Yes
CYP1A2 Inhibitor Yes
CYP2C19 Inhibitor No
CYP2C9 Inhibitor No
CYP2D6 Inhibitor No
CYP3A4 Inhibitor No
GI Absorption High
LogKp -5.51 cm/s
P-gp Substrate No
Fraction Csp3 0.12
GHS Pictogram GHS07
Hazard Statements H315-H319-H335
Precautionary Statements P261-P305+P351+P338

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