Molecule

ID:111484

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₄
Molecular Mass
204.35106
Exact Mass
204.18780077
Charge
0
InChI
InChI=1S/C15H24/c1-10(2)13-7-14(11(3)4)9-15(8-13)12(5)6/h7-12H,1-6H3
InChIKey
VUMCUSHVMYIRMB-UHFFFAOYSA-N
Canonic Smiles
CC(c1cc(cc(c1)C(C)C)C(C)C)C
Isomeric Smiles
CC(C)c1cc(cc(c1)C(C)C)C(C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.7082734
LogD (pH = 7.4)
5.7082734
Log P
5.7082734
Molar Refractivity
68.6304
Polarizability
26.76624
Polar Surface Area
0.0
Rotatable Bonds
3
Lipinski's Rule of Five
false
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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