Molecule

ID:90315

General Information
Structure
MolImage
Molecular Formula
C₆H₁₂Br₂
Molecular Mass
243.96748
Exact Mass
241.93057438
Charge
0
InChI
InChI=1S/C6H12Br2/c1-6(2-4-7)3-5-8/h6H,2-5H2,1H3
InChIKey
YDPZWUMQKMLLHC-UHFFFAOYSA-N
Canonic Smiles
BrCCC(CCBr)C
Isomeric Smiles
BrCCC(CCBr)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.1804054
LogD (pH = 7.4)
3.1804054
Log P
3.1804054
Molar Refractivity
45.2822
Polarizability
17.449108
Polar Surface Area
0.0
Rotatable Bonds
4
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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