Molecule

ID:120395

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₆O
Molecular Mass
152.23344
Exact Mass
152.12011513
Charge
0
InChI
InChI=1S/C10H16O/c1-8(2)7-9-5-3-4-6-10(9)11/h7-8H,3-6H2,1-2H3/b9-7-
InChIKey
WVANVZNUDWLCTQ-CLFYSBASSA-N
Canonic Smiles
CC(/C=C\1/CCCCC1=O)C
Isomeric Smiles
C\1(=C/C(C)C)/C(=O)CCCC1
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.0577247
LogD (pH = 7.4)
3.0577247
Log P
3.0577247
Molar Refractivity
47.4484
Polarizability
18.259748
Polar Surface Area
17.07
Rotatable Bonds
1
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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