Molecule

ID:112823

General Information
Structure
MolImage
Molecular Formula
C₁₁H₁₆
Molecular Mass
148.24474
Exact Mass
148.12520051
Charge
0
InChI
InChI=1S/C11H16/c1-3-5-7-9-11-10-8-6-4-2/h7-11H2,1-2H3
InChIKey
FKKNTXVGHXTKPZ-UHFFFAOYSA-N
Canonic Smiles
CC#CCCCCCC#CC
Isomeric Smiles
CC#CCCCCCC#CC
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.5233946
LogD (pH = 7.4)
4.5233946
Log P
4.5233946
Molar Refractivity
51.135998
Polarizability
18.842913
Polar Surface Area
0.0
Rotatable Bonds
6
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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