Molecule

ID:99669

General Information
Structure
MolImage
Molecular Formula
C₄H₃Br₂F₅
Molecular Mass
305.866636
Exact Mass
303.8521652
Charge
0
InChI
InChI=1S/C4H3Br2F5/c5-2(4(6,10)11)1-3(7,8)9/h2H,1H2
InChIKey
MQOPSKICBXWWDP-UHFFFAOYSA-N
Canonic Smiles
BrC(C(Br)(F)F)CC(F)(F)F
Isomeric Smiles
FC(Br)(F)C(CC(F)(F)F)Br
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.2215135
LogD (pH = 7.4)
3.2215135
Log P
3.2215135
Molar Refractivity
36.9613
Polarizability
14.3243685
Polar Surface Area
0.0
Rotatable Bonds
3
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
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References
Bioactivity
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