Molecule

ID:96994

General Information
Structure
MolImage
Molecular Formula
C₇H₆ClF
Molecular Mass
144.5739432
Exact Mass
144.01420609
Charge
0
InChI
InChI=1S/C7H6ClF/c8-5-6-2-1-3-7(9)4-6/h1-4H,5H2
InChIKey
XBDXMDVEZLOGMC-UHFFFAOYSA-N
Canonic Smiles
ClCc1cccc(c1)F
Isomeric Smiles
ClCc1cc(ccc1)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.7031898
LogD (pH = 7.4)
2.7031898
Log P
2.7031898
Molar Refractivity
36.1413
Polarizability
13.673686
Polar Surface Area
0.0
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