Molecule

ID:77486

General Information
Structure
Molecular Formula
C₅H₃Cl₂N
Molecular Mass
147.99002
Exact Mass
146.96425446
Charge
0
InChI
InChI=1S/C5H3Cl2N/c6-4-2-1-3-5(7)8-4/h1-3H
InChIKey
FILKGCRCWDMBKA-UHFFFAOYSA-N
Canonic Smiles
Clc1cccc(n1)Cl
Isomeric Smiles
n1c(cccc1Cl)Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.4040172
LogD (pH = 7.4)
2.4040172
Log P
2.4040172
Molar Refractivity
35.6333
Polarizability
13.351268
Polar Surface Area
12.89
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation