Molecule

ID:112647

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₈
Molecular Mass
138.24992
Exact Mass
138.14085058
Charge
0
InChI
InChI=1S/C10H18/c1-9(2)8-10-6-4-3-5-7-10/h10H,1,3-8H2,2H3
InChIKey
NPOMKHQWAVPNRY-UHFFFAOYSA-N
Canonic Smiles
CC(=C)CC1CCCCC1
Isomeric Smiles
CC(=C)CC1CCCCC1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.7829418
LogD (pH = 7.4)
3.7829418
Log P
3.7829418
Molar Refractivity
45.6827
Polarizability
18.241005
Polar Surface Area
0.0
Rotatable Bonds
2
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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