Molecule

ID:82212

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀BrCl
Molecular Mass
185.4899
Exact Mass
183.96544
Charge
0
InChI
InChI=1S/C5H10BrCl/c6-4-2-1-3-5-7/h1-5H2
InChIKey
PHHNNDKXQVKJEP-UHFFFAOYSA-N
Canonic Smiles
ClCCCCCBr
Isomeric Smiles
ClCCCCCBr
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.707891
LogD (pH = 7.4)
2.707891
Log P
2.707891
Molar Refractivity
37.7501
Polarizability
14.5900755
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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