Molecule

ID:10710

General Information

Structure

MolImage

Molecular Formula

C₁₂H₂₄

Molecular Mass

168.31896

Exact Mass

168.18780077

Charge

0

InChI

InChI=1S/C12H24/c1-10(8-11(2,3)4)9-12(5,6)7/h1,8-9H2,2-7H3

InChIKey

TUFZRYOCZCLYJO-UHFFFAOYSA-N

Canonic Smiles

C=C(CC(C)(C)C)CC(C)(C)C

Isomeric Smiles

C(=C)(CC(C)(C)C)CC(C)(C)C

Calculated Properties

JChem

H Acceptors

0

H Donor

0

LogD (pH = 5.5)

4.6892123

LogD (pH = 7.4)

4.6892123

Log P

4.6892123

Molar Refractivity

56.3827

Polarizability

22.682592

Polar Surface Area

0.0

Rotatable Bonds

4

Lipinski's Rule of Five

true

Data Source

Names and Identifiers

Registration numbers

Properties

Related Proteins

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Molecular Spectra

No Data Available

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Molecule Details

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References

Bioactivity