Molecule

ID:73716

General Information

Structure

MolImage

Molecular Formula

C₉H₁₇Cl

Molecular Mass

160.68428

Exact Mass

160.10187822

Charge

0

InChI

InChI=1S/C9H17Cl/c1-3-4-5-6-7-8-9(2)10/h2-8H2,1H3

InChIKey

LFXZYKAMIOLQOZ-UHFFFAOYSA-N

Canonic Smiles

CCCCCCCC(=C)Cl

Isomeric Smiles

ClC(=C)CCCCCCC

Calculated Properties

JChem

H Acceptors

0

H Donor

0

LogD (pH = 5.5)

4.2417116

LogD (pH = 7.4)

4.2417116

Log P

4.2417116

Molar Refractivity

48.1255

Polarizability

18.893288

Polar Surface Area

0.0

Rotatable Bonds

6

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