Molecule

ID:110412

General Information

Structure

MolImage

Molecular Formula

C₁₇H₃₄O₂

Molecular Mass

270.45066

Exact Mass

270.25588033

Charge

0

InChI

InChI=1S/C17H34O2/c1-4-7-9-10-11-12-14-17(18)19-15-16(6-3)13-8-5-2/h16H,4-15H2,1-3H3

InChIKey

CCFWAONPPYWNDM-UHFFFAOYSA-N

Canonic Smiles

CCCCCCCCC(=O)OCC(CCCC)CC

Isomeric Smiles

CCCCCCCCC(=O)OCC(CC)CCCC

Calculated Properties

JChem

H Acceptors

1

H Donor

0

LogD (pH = 5.5)

6.313074

LogD (pH = 7.4)

6.313074

Log P

6.313074

Molar Refractivity

81.7939

Polarizability

32.81786

Polar Surface Area

26.3

Rotatable Bonds

14

Lipinski's Rule of Five

false

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