Molecule
ID:83399
General Information
Molecular Formula
C₈H₁₄Br₂
Molecular Mass
270.00476
Exact Mass
267.94622445
Charge
0
InChI
InChI=1S/C8H14Br2/c1-2-3-4-5-7-6-8(7,9)10/h7H,2-6H2,1H3
InChIKey
UQONUUXVHJXAIW-UHFFFAOYSA-N
Canonic Smiles
CCCCCC1CC1(Br)Br
Isomeric Smiles
BrC1(CC1CCCCC)Br
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.6816638
LogD (pH = 7.4)
3.6816638
Log P
3.6816638
Molar Refractivity
52.6894
Polarizability
20.351778
Polar Surface Area
0.0
Rotatable Bonds
4
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
No Data Available
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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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