Molecule

ID:64282

General Information
Structure
MolImage
Molecular Formula
C₅H₇Br
Molecular Mass
147.01308
Exact Mass
145.97311222
Charge
0
InChI
InChI=1S/C5H7Br/c6-5-3-1-2-4-5/h3H,1-2,4H2
InChIKey
XNHUZSZMXSLTQL-UHFFFAOYSA-N
Canonic Smiles
BrC1=CCCC1
Isomeric Smiles
C1(=CCCC1)Br
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.1064854
LogD (pH = 7.4)
2.1064854
Log P
2.1064854
Molar Refractivity
31.8098
Polarizability
11.719718
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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