Molecule

ID:8949

General Information
Structure
Molecular Formula
C₂Cl₂F₃I
Molecular Mass
278.8270796
Exact Mass
277.83738802
Charge
0
InChI
InChI=1S/C2Cl2F3I/c3-1(4,5)2(6,7)8
InChIKey
ZKSPBOZWNYOYLJ-UHFFFAOYSA-N
Canonic Smiles
FC(C(Cl)(Cl)F)(I)F
Isomeric Smiles
C(C(F)(I)F)(Cl)(F)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.6064
LogD (pH = 7.4)
2.6064
Log P
2.6064
Molar Refractivity
35.5135
Polarizability
13.841062
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