Molecule

ID:107643

General Information
Structure
MolImage
Molecular Formula
C₁₈H₃₆
Molecular Mass
252.47844
Exact Mass
252.28170115
Charge
0
InChI
InChI=1S/C18H36/c1-3-5-7-9-11-13-15-17-18-16-14-12-10-8-6-4-2/h3H,1,4-18H2,2H3
InChIKey
CCCMONHAUSKTEQ-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCCCCCCCCC=C
Isomeric Smiles
CCCCCCCCCCCCCCCCC=C
Calculated Properties
JChem
LogD (pH = 7.4)
8.16
LogD (pH = 5.5)
8.16
Log P
8.16
Rotatable Bonds
15
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
false
Polar Surface Area
0.00
Polarizability
36.66
Molar Refractivity
84.66
LOG S
-8.98
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation