Molecule

ID:107136

General Information
Structure
MolImage
Molecular Formula
C₅H₁₀Cl₂
Molecular Mass
141.0389
Exact Mass
140.01595568
Charge
0
InChI
InChI=1S/C5H10Cl2/c1-3-5(7)4(2)6/h4-5H,3H2,1-2H3
InChIKey
HVFJQRZGBBKTPL-UHFFFAOYSA-N
Canonic Smiles
CCC(C(Cl)C)Cl
Isomeric Smiles
CCC(Cl)C(C)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.856177
LogD (pH = 7.4)
2.856177
Log P
2.856177
Molar Refractivity
34.0172
Polarizability
13.618647
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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