Molecule

ID:80392

General Information
Structure
MolImage
Molecular Formula
C₁₄H₂₄O₄
Molecular Mass
256.33796
Exact Mass
256.16745925
Charge
0
InChI
InChI=1S/C14H24O4/c1-3-17-13(15)9-8-11-6-5-7-12(10-11)14(16)18-4-2/h11-12H,3-10H2,1-2H3
InChIKey
OKHHFAGPJJDJSF-UHFFFAOYSA-N
Canonic Smiles
CCOC(=O)CCC1CCCC(C1)C(=O)OCC
Isomeric Smiles
O=C(C1CC(CCC(=O)OCC)CCC1)OCC
Calculated Properties
JChem
H Acceptors
2
H Donor
0
LogD (pH = 5.5)
2.751475
LogD (pH = 7.4)
2.751475
Log P
2.751475
Molar Refractivity
68.2973
Polarizability
27.336819
Polar Surface Area
52.6
Rotatable Bonds
8
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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