Molecule
ID:11853
General Information
Molecular Formula
C₃BrF₅
Molecular Mass
210.928116
Exact Mass
209.9103531
Charge
0
InChI
InChI=1S/C3BrF5/c4-2(6)1(5)3(7,8)9/b2-1+
InChIKey
LNSBXPNZJPZBQZ-OWOJBTEDSA-N
Canonic Smiles
F/C(=C(\C(F)(F)F)/F)/Br
Isomeric Smiles
C(/C(=C(/Br)\F)/F)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.2500832
LogD (pH = 7.4)
2.2500832
Log P
2.2500832
Molar Refractivity
35.0731
Polarizability
9.1933155
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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