Molecule

ID:10371

General Information
Structure
MolImage
Molecular Formula
C₃H₄BrF₃
Molecular Mass
176.9630696
Exact Mass
175.94484679
Charge
0
InChI
InChI=1S/C3H4BrF3/c4-2-1-3(5,6)7/h1-2H2
InChIKey
SAUGMJLWYLQPEM-UHFFFAOYSA-N
Canonic Smiles
BrCCC(F)(F)F
Isomeric Smiles
C(CCBr)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.9695065
LogD (pH = 7.4)
1.9695065
Log P
1.9695065
Molar Refractivity
24.1977
Polarizability
9.157127
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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