Molecule

ID:112671

General Information

Structure

MolImage

Molecular Formula

C₁₀H₂₀O

Molecular Mass

156.2652

Exact Mass

156.15141526

Charge

0

InChI

InChI=1S/C10H20O/c1-4-6-8-10(11)9(3)7-5-2/h9H,4-8H2,1-3H3

InChIKey

CGHJMKONNFWXHO-UHFFFAOYSA-N

Canonic Smiles

CCCCC(=O)C(CCC)C

Isomeric Smiles

CCCCC(=O)C(C)CCC

Calculated Properties

JChem

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

3.8286123

LogD (pH = 7.4)

3.8286123

Log P

3.8286123

Molar Refractivity

48.4271

Polarizability

19.23295

Polar Surface Area

17.07

Rotatable Bonds

6

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