Molecule

ID:77996

General Information
Structure
MolImage
Molecular Formula
C₃H₃Cl₅
Molecular Mass
216.32092
Exact Mass
213.8677385
Charge
0
InChI
InChI=1S/C3H3Cl5/c4-2(5)1-3(6,7)8/h2H,1H2
InChIKey
VVWFZKBKXPXGBH-UHFFFAOYSA-N
Canonic Smiles
ClC(CC(Cl)(Cl)Cl)Cl
Isomeric Smiles
ClC(CC(Cl)(Cl)Cl)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.9151776
LogD (pH = 7.4)
2.9151776
Log P
2.9151776
Molar Refractivity
40.7727
Polarizability
15.8644085
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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