Molecule

ID:74316

General Information
Structure
MolImage
Molecular Formula
C₁₂H₂₄O
Molecular Mass
184.31836
Exact Mass
184.18271539
Charge
0
InChI
InChI=1S/C12H24O/c13-12-10-8-6-4-2-1-3-5-7-9-11-12/h12-13H,1-11H2
InChIKey
SFVWPXMPRCIVOK-UHFFFAOYSA-N
Canonic Smiles
OC1CCCCCCCCCCC1
Isomeric Smiles
OC1CCCCCCCCCCC1
Calculated Properties
JChem
Acid pKa
18.484173
H Acceptors
1
H Donor
1
LogD (pH = 5.5)
3.9481053
LogD (pH = 7.4)
3.9481053
Log P
3.9481053
Molar Refractivity
56.8815
Polarizability
22.737331
Polar Surface Area
20.23
Rotatable Bonds
0
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
References
Bioactivity
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