Molecule

ID:70092

General Information
Structure
MolImage
Molecular Formula
C₉H₁₈Br₂
Molecular Mass
286.04722
Exact Mass
283.97752458
Charge
0
InChI
InChI=1S/C9H18Br2/c10-8-6-4-2-1-3-5-7-9-11/h1-9H2
InChIKey
WGAXVZXBFBHLMC-UHFFFAOYSA-N
Canonic Smiles
BrCCCCCCCCCBr
Isomeric Smiles
C(CCCCCCCCBr)Br
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.671661
LogD (pH = 7.4)
4.671661
Log P
4.671661
Molar Refractivity
59.1376
Polarizability
22.806591
Polar Surface Area
0.0
Rotatable Bonds
8
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
References
Bioactivity
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