Molecule

ID:104823

General Information
Structure
MolImage
Molecular Formula
C₁₆H₃₄
Molecular Mass
226.44116
Exact Mass
226.26605109
Charge
0
InChI
InChI=1S/C16H34/c1-13(10-14(2,3)4)11-16(8,9)12-15(5,6)7/h13H,10-12H2,1-9H3
InChIKey
VCLJODPNBNEBKW-UHFFFAOYSA-N
Canonic Smiles
CC(CC(CC(C)(C)C)(C)C)CC(C)(C)C
Isomeric Smiles
CC(CC(C)(C)C)CC(C)(C)CC(C)(C)C
Calculated Properties
JChem
LogD (pH = 7.4)
6.51
LogD (pH = 5.5)
6.51
Log P
6.51
Rotatable Bonds
6
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
false
Polar Surface Area
0.00
Polarizability
30.89
Molar Refractivity
74.83
LOG S
-6.95
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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