Molecule

ID:136633

General Information
Structure
MolImage
Molecular Formula
C₁₇H₃₄O₂
Molecular Mass
272.43596968
Exact Mass
272.26259
Charge
0
InChI
InChI=1S/C17H34O2/c1-4-5-6-7-8-9-10-11-12-13-14-15-17(18)19-16(2)3/h16H,4-15H2,1-3H3/i15+1,17+1
InChIKey
AXISYYRBXTVTFY-YSNSLIITSA-N
Canonic Smiles
CCCCCCCCCCCC[13CH2][13C](=O)OC(C)C
Isomeric Smiles
CCCCCCCCCCCC[13CH2][13C](=O)OC(C)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
6.2867227
LogD (pH = 7.4)
6.2867227
Log P
6.2867227
Molar Refractivity
81.8181
Polarizability
32.81786
Polar Surface Area
26.3
Rotatable Bonds
14
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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