Molecule

ID:3385

General Information
Structure
MolImage
Molecular Formula
C₂H₄Cl₂
Molecular Mass
98.95916
Exact Mass
97.96900549
Charge
0
InChI
InChI=1S/C2H4Cl2/c3-1-2-4/h1-2H2
InChIKey
WSLDOOZREJYCGB-UHFFFAOYSA-N
Canonic Smiles
ClCCCl
Isomeric Smiles
ClCCCl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.5005046
LogD (pH = 7.4)
1.5005046
Log P
1.5005046
Molar Refractivity
20.6556
Polarizability
8.169801
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
ALOGPS 2.1
Log P
1.48
LOG S
-1.22
Solubility (Water)
5.94e+00 g/l
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
No Data Available
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Molecule Details
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References
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Bioactivity
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