Molecule

ID:109558

General Information
Structure
MolImage
Molecular Formula
C₁₅H₂₈O₂
Molecular Mass
240.38162
Exact Mass
240.20893014
Charge
0
InChI
InChI=1S/C15H28O2/c1-3-5-7-8-9-10-11-12-13-15(16)17-14-6-4-2/h3H,1,4-14H2,2H3
InChIKey
GRAORJFMGCQWRN-UHFFFAOYSA-N
Canonic Smiles
CCCCOC(=O)CCCCCCCCC=C
Isomeric Smiles
CCCCOC(=O)CCCCCCCCC=C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
5.1995444
LogD (pH = 7.4)
5.1995444
Log P
5.1995444
Molar Refractivity
72.7654
Polarizability
28.89051
Polar Surface Area
26.3
Rotatable Bonds
13
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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