Molecule

ID:7855

General Information
Structure
MolImage
Molecular Formula
C₇H₂Cl₃F₃
Molecular Mass
249.4449896
Exact Mass
247.91741776
Charge
0
InChI
InChI=1S/C7H2Cl3F3/c8-4-1-3(7(11,12)13)2-5(9)6(4)10/h1-2H
InChIKey
FBKFIAIRSQOXJR-UHFFFAOYSA-N
Canonic Smiles
Clc1c(Cl)cc(cc1Cl)C(F)(F)F
Isomeric Smiles
c1(c(c(cc(c1)C(F)(F)F)Cl)Cl)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.6632285
LogD (pH = 7.4)
4.6632285
Log P
4.6632285
Molar Refractivity
46.4461
Polarizability
17.556902
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
暂无数据
点击上传数据
References
Bioactivity
Navigation