Molecule

ID:81161

General Information
Structure
MolImage
Molecular Formula
C₁₀H₂₂
Molecular Mass
142.28168
Exact Mass
142.1721507
Charge
0
InChI
InChI=1S/C10H22/c1-6-9(3)8-10(4,5)7-2/h9H,6-8H2,1-5H3
InChIKey
VRVRZZWPKABUOE-UHFFFAOYSA-N
Canonic Smiles
CCC(CC(CC)(C)C)C
Isomeric Smiles
CCC(CC(CC)C)(C)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.449792
LogD (pH = 7.4)
4.449792
Log P
4.449792
Molar Refractivity
47.5815
Polarizability
19.216736
Polar Surface Area
0.0
Rotatable Bonds
4
Lipinski's Rule of Five
true
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
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References
Bioactivity
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