Molecule

ID:7352

General Information
Structure
Molecular Formula
C₆H₄ClI
Molecular Mass
238.45343
Exact Mass
237.90462581
Charge
0
InChI
InChI=1S/C6H4ClI/c7-5-2-1-3-6(8)4-5/h1-4H
InChIKey
JMLWXCJXOYDXRN-UHFFFAOYSA-N
Canonic Smiles
Clc1cccc(c1)I
Isomeric Smiles
c1cc(cc(c1)Cl)I
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.506235
LogD (pH = 7.4)
3.506235
Log P
3.506235
Molar Refractivity
44.2253
Polarizability
17.431189
Polar Surface Area
0.0
Rotatable Bonds
0
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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