Molecule

ID:89786

General Information
Structure
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Molecular Formula
C₅H₁₁Br
Molecular Mass
151.04484
Exact Mass
150.00441235
Charge
0
InChI
InChI=1S/C5H11Br/c1-2-3-4-5-6/h2-5H2,1H3
InChIKey
YZWKKMVJZFACSU-UHFFFAOYSA-N
Canonic Smiles
CCCCCBr
Isomeric Smiles
BrCCCCC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.7899778
LogD (pH = 7.4)
2.7899778
Log P
2.7899778
Molar Refractivity
32.7704
Polarizability
12.648056
Polar Surface Area
0.0
Rotatable Bonds
3
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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