Molecule

ID:106913

General Information
Structure
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Molecular Formula
C₆H₂Cl₄
Molecular Mass
215.89208
Exact Mass
213.89106078
Charge
0
InChI
InChI=1S/C6H2Cl4/c7-3-1-2-4(8)6(10)5(3)9/h1-2H
InChIKey
GBDZXPJXOMHESU-UHFFFAOYSA-N
Canonic Smiles
Clc1c(Cl)ccc(c1Cl)Cl
Isomeric Smiles
Clc1ccc(Cl)c(Cl)c1Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.3894243
LogD (pH = 7.4)
4.3894243
Log P
4.3894243
Molar Refractivity
45.2772
Polarizability
18.063013
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
No Data Available
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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