Molecule

ID:89697

General Information
Structure
MolImage
Molecular Formula
C₉H₉Cl
Molecular Mass
152.62076
Exact Mass
152.03927797
Charge
0
InChI
InChI=1S/C9H9Cl/c10-8-4-7-9-5-2-1-3-6-9/h1-7H,8H2
InChIKey
IWTYTFSSTWXZFU-UHFFFAOYSA-N
Canonic Smiles
ClC/C=C/c1ccccc1
Isomeric Smiles
ClC/C=C/c1ccccc1
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.1704035
LogD (pH = 7.4)
3.1704035
Log P
3.1704035
Molar Refractivity
46.2435
Polarizability
17.511305
Polar Surface Area
0.0
Rotatable Bonds
2
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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