Molecule

ID:76837

General Information
Structure
MolImage
Molecular Formula
C₈H₁₀
Molecular Mass
106.165
Exact Mass
106.07825032
Charge
0
InChI
InChI=1S/C8H10/c1-2-8-6-4-3-5-7-8/h1,6H,3-5,7H2
InChIKey
DKFHWNGVMWFBJE-UHFFFAOYSA-N
Canonic Smiles
C#CC1=CCCCC1
Isomeric Smiles
C#CC1=CCCCC1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.1862655
LogD (pH = 7.4)
2.1862655
Log P
2.1862655
Molar Refractivity
36.0672
Polarizability
13.436259
Polar Surface Area
0.0
Rotatable Bonds
0
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
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