Molecule

ID:135524

General Information
Structure
MolImage
Molecular Formula
C₂H₂Cl₄
Molecular Mass
169.83458968
Exact Mass
167.89777046
Charge
0
InChI
InChI=1S/C2H2Cl4/c3-1(4)2(5)6/h1-2H/i1+1,2+1
InChIKey
QPFMBZIOSGYJDE-ZDOIIHCHSA-N
Canonic Smiles
Cl[13CH]([13CH](Cl)Cl)Cl
Isomeric Smiles
[13CH]([13CH](Cl)Cl)(Cl)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.8379052
LogD (pH = 7.4)
2.8379052
Log P
2.8379052
Molar Refractivity
30.7638
Polarizability
12.106033
Polar Surface Area
0.0
Rotatable Bonds
1
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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