Molecule

ID:10397

General Information
Structure
MolImage
Molecular Formula
C₂HBr₂F₃
Molecular Mass
241.8325496
Exact Mass
239.83970869
Charge
0
InChI
InChI=1S/C2HBr2F3/c3-1(4)2(5,6)7/h1H
InChIKey
YUQQQYGEDJGUCI-UHFFFAOYSA-N
Canonic Smiles
BrC(C(F)(F)F)Br
Isomeric Smiles
C(C(F)(F)F)(Br)Br
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.032456
LogD (pH = 7.4)
2.032456
Log P
2.032456
Molar Refractivity
27.4497
Polarizability
10.788071
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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