Molecule

ID:136119

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₈
Molecular Mass
140.23522968
Exact Mass
140.14756025
Charge
0
InChI
InChI=1S/C10H18/c1-3-5-7-9-10-8-6-4-2/h1H,4-10H2,2H3/i1+1,3+1
InChIKey
ILLHQJIJCRNRCJ-ZKDXJZICSA-N
Canonic Smiles
CCCCCCCC[13C]#[13CH]
Isomeric Smiles
CCCCCCCC[13C]#[13CH]
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.1022577
LogD (pH = 7.4)
4.1022577
Log P
4.1022577
Molar Refractivity
46.2738
Polarizability
18.105852
Polar Surface Area
0.0
Rotatable Bonds
6
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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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
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Bioactivity
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