Molecule

ID:98524

General Information
Structure
MolImage
Molecular Formula
C₄H₄Br₂F₄
Molecular Mass
287.8761728
Exact Mass
285.86158701
Charge
0
InChI
InChI=1S/C4H4Br2F4/c1-3(6,7)2(5)4(8,9)10/h2H,1H3
InChIKey
PIYSTBVKCZROID-UHFFFAOYSA-N
Canonic Smiles
BrC(C(Br)(F)C)C(F)(F)F
Isomeric Smiles
FC(C(C(F)(F)F)Br)(Br)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.0813098
LogD (pH = 7.4)
3.0813098
Log P
3.0813098
Molar Refractivity
36.7334
Polarizability
14.192163
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
No Data Available
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Molecule Details
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References
Bioactivity
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