Molecule

ID:121634

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₈O
Molecular Mass
154.24932
Exact Mass
154.1357652
Charge
0
InChI
InChI=1S/C10H18O/c1-2-3-4-6-9-7-5-8-10(9)11/h9H,2-8H2,1H3
InChIKey
VNWOJVJCRAHBJJ-UHFFFAOYSA-N
Canonic Smiles
CCCCCC1CCCC1=O
Isomeric Smiles
C1(=O)C(CCC1)CCCCC
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.3648865
LogD (pH = 7.4)
3.3648865
Log P
3.3648865
Molar Refractivity
46.6249
Polarizability
18.4969
Polar Surface Area
17.07
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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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
Bioactivity
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