Molecule

ID:107000

General Information
Structure
MolImage
Molecular Formula
C₈H₁₇Cl
Molecular Mass
148.67358
Exact Mass
148.10187822
Charge
0
InChI
InChI=1S/C8H17Cl/c1-2-3-4-5-6-7-8-9/h2-8H2,1H3
InChIKey
CNDHHGUSRIZDSL-UHFFFAOYSA-N
Canonic Smiles
CCCCCCCCCl
Isomeric Smiles
CCCCCCCCCl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.9381886
LogD (pH = 7.4)
3.9381886
Log P
3.9381886
Molar Refractivity
43.5899
Polarizability
17.27875
Polar Surface Area
0.0
Rotatable Bonds
6
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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