Molecule

ID:100780

General Information
Structure
MolImage
Molecular Formula
C₃HBrF₄
Molecular Mass
192.9376528
Exact Mass
191.91977491
Charge
0
InChI
InChI=1S/C3HBrF4/c4-1-2(5)3(6,7)8/h1H
InChIKey
RRUCZSCEAWFDBM-UHFFFAOYSA-N
Canonic Smiles
Br/C=C(/C(F)(F)F)\F
Isomeric Smiles
FC(/C(=C/Br)/F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.115197
LogD (pH = 7.4)
2.115197
Log P
2.115197
Molar Refractivity
24.3292
Polarizability
9.033127
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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