Molecule

ID:135417

General Information
Structure
MolImage
Molecular Formula
C₅H₈Cl₄
Molecular Mass
209.92902
Exact Mass
207.93801098
Charge
0
InChI
InChI=1S/C5H8Cl4/c6-1-5(2-7,3-8)4-9/h1-4H2
InChIKey
KPZGRMZPZLOPBS-UHFFFAOYSA-N
Canonic Smiles
ClCC(CCl)(CCl)CCl
Isomeric Smiles
C(C(CCl)(CCl)CCl)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.679781
LogD (pH = 7.4)
2.679781
Log P
2.679781
Molar Refractivity
43.9317
Polarizability
17.451176
Polar Surface Area
0.0
Rotatable Bonds
4
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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Molecular Spectra
Molecule Details
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References
Bioactivity
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