Molecule

ID:79670

General Information

Structure

Molecular Formula

C₇H₁₀

Molecular Mass

94.1543

Exact Mass

94.07825032

Charge

0

InChI

InChI=1S/C7H10/c1-2-5-6-3-4(1)7(5)6/h4-7H,1-3H2

InChIKey

YDOHPBBLOFQPQE-UHFFFAOYSA-N

Canonic Smiles

C1CC2C3C1CC23

Isomeric Smiles

C1C2CCC3C1C23

Calculated Properties

JChem

H Acceptors

0

H Donor

0

LogD (pH = 5.5)

1.5543306

LogD (pH = 7.4)

1.5543306

Log P

1.5543306

Molar Refractivity

28.393

Polarizability

11.4454775

Polar Surface Area

0.0

Rotatable Bonds

0

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