Molecule

ID:112872

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₂
Molecular Mass
142.28168
Exact Mass
142.1721507
Charge
0
InChI
InChI=1S/C10H22/c1-5-7-8-9-10(3,4)6-2/h5-9H2,1-4H3
InChIKey
DBULLUBYDONGLT-UHFFFAOYSA-N
Canonic Smiles
CCCCCC(CC)(C)C
Isomeric Smiles
CCCCCC(C)(C)CC
Calculated Properties
JChem
LogD (pH = 7.4)
4.61
LogD (pH = 5.5)
4.61
Log P
4.61
Rotatable Bonds
5
H Donor
0
H Acceptors
0
Lipinski's Rule of Five
true
Polar Surface Area
0.00
Polarizability
19.89
Molar Refractivity
47.63
LOG S
-4.70
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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