Molecule

ID:32936

General Information
Structure
MolImage
Molecular Formula
C₇H₅BrF₂
Molecular Mass
207.0154064
Exact Mass
205.9542686
Charge
0
InChI
InChI=1S/C7H5BrF2/c8-6-3-1-5(2-4-6)7(9)10/h1-4,7H
InChIKey
HUSPSWKWFREKSS-UHFFFAOYSA-N
Canonic Smiles
FC(c1ccc(cc1)Br)F
Isomeric Smiles
c1(ccc(cc1)C(F)F)Br
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.1310863
LogD (pH = 7.4)
3.1310863
Log P
3.1310863
Molar Refractivity
38.7648
Polarizability
14.676363
Polar Surface Area
0.0
Rotatable Bonds
1
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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