Molecule

ID:112371

General Information
Structure
MolImage
Molecular Formula
C₁₁H₁₄
Molecular Mass
146.22886
Exact Mass
146.10955045
Charge
0
InChI
InChI=1S/C11H14/c1-10(2)8-9-11-6-4-3-5-7-11/h3-7H,1,8-9H2,2H3
InChIKey
SNOWWVSDFCWQJK-UHFFFAOYSA-N
Canonic Smiles
CC(=C)CCc1ccccc1
Isomeric Smiles
CC(=C)CCc1ccccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.7597466
LogD (pH = 7.4)
3.7597466
Log P
3.7597466
Molar Refractivity
49.2283
Polarizability
19.323278
Polar Surface Area
0.0
Rotatable Bonds
3
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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