Molecule

ID:8950

General Information
Structure
MolImage
Molecular Formula
C₆H₃Cl₂I
Molecular Mass
272.89849
Exact Mass
271.86565346
Charge
0
InChI
InChI=1S/C6H3Cl2I/c7-4-1-2-5(8)6(9)3-4/h1-3H
InChIKey
SBHVNORGKIPGCL-UHFFFAOYSA-N
Canonic Smiles
Clc1ccc(c(c1)I)Cl
Isomeric Smiles
c1c(cc(c(c1)Cl)I)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.1102796
LogD (pH = 7.4)
4.1102796
Log P
4.1102796
Molar Refractivity
49.0301
Polarizability
19.4412
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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