Molecule

ID:110720

General Information

Structure

MolImage

Molecular Formula

C₁₀H₂₀O

Molecular Mass

156.2652

Exact Mass

156.15141526

Charge

0

InChI

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

InChIKey

BMLJPODSPMQJKF-UHFFFAOYSA-N

Canonic Smiles

CCCCCCC(C(=O)C)C

Isomeric Smiles

CCCCCCC(C)C(=O)C

Calculated Properties

JChem

Acid pKa

19.513744

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

3.5726452

LogD (pH = 7.4)

3.5726452

Log P

3.5726452

Molar Refractivity

48.4012

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