Molecule

ID:85287

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₀Cl₂
Molecular Mass
201.0924
Exact Mass
200.01595568
Charge
0
InChI
InChI=1S/C10H10Cl2/c11-10(12)7-9(10)6-8-4-2-1-3-5-8/h1-5,9H,6-7H2
InChIKey
DGWQDTVVILBZOP-UHFFFAOYSA-N
Canonic Smiles
ClC1(Cl)CC1Cc1ccccc1
Isomeric Smiles
ClC1(C(C1)Cc1ccccc1)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.7451127
LogD (pH = 7.4)
3.7451127
Log P
3.7451127
Molar Refractivity
53.3482
Polarizability
20.540798
Polar Surface Area
0.0
Rotatable Bonds
2
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
No Data Available
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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
Bioactivity
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