Molecule
ID:89806
General Information
Molecular Formula
C₁₀H₂₂O
Molecular Mass
158.28108
Exact Mass
158.16706532
Charge
0
InChI
InChI=1S/C10H22O/c1-3-4-5-6-7-8-9-10-11-2/h3-10H2,1-2H3
InChIKey
BRIKTKRHROTQFO-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCOC
Isomeric Smiles
O(CCCCCCCCC)C
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.6712918
LogD (pH = 7.4)
3.6712918
Log P
3.6712918
Molar Refractivity
49.8911
Polarizability
19.858446
Polar Surface Area
9.23
Rotatable Bonds
8
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
No Data Available
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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