Molecule

ID:10261

General Information
Structure
MolImage
Molecular Formula
C₇H₃Cl₃O
Molecular Mass
209.45712
Exact Mass
207.92494776
Charge
0
InChI
InChI=1S/C7H3Cl3O/c8-5-1-4(7(10)11)2-6(9)3-5/h1-3H
InChIKey
GGHLXLVPNZMBQR-UHFFFAOYSA-N
Canonic Smiles
Clc1cc(Cl)cc(c1)C(=O)Cl
Isomeric Smiles
c1c(cc(cc1C(=O)Cl)Cl)Cl
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
3.3722477
LogD (pH = 7.4)
3.3722477
Log P
3.3722477
Molar Refractivity
46.7823
Polarizability
17.958988
Polar Surface Area
17.07
Rotatable Bonds
1
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