Molecule

ID:45018

General Information
Structure
MolImage
Molecular Formula
C₄H₇Br
Molecular Mass
135.00238
Exact Mass
133.97311222
Charge
0
InChI
InChI=1S/C4H7Br/c1-2-3-4-5/h2H,1,3-4H2
InChIKey
DMAYBPBPEUFIHJ-UHFFFAOYSA-N
Canonic Smiles
BrCCC=C
Isomeric Smiles
BrCCC=C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.0414212
LogD (pH = 7.4)
2.0414212
Log P
2.0414212
Molar Refractivity
28.2135
Polarizability
10.592228
Polar Surface Area
0.0
Rotatable Bonds
2
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
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Related Proteins
No Data Available
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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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