Molecule

ID:10591

General Information
Structure
MolImage
Molecular Formula
C₇Cl₂F₆
Molecular Mass
268.9713192
Exact Mass
267.92812468
Charge
0
InChI
InChI=1S/C7Cl2F6/c8-2-4(10)1(7(13,14)15)5(11)3(9)6(2)12
InChIKey
GMAAQKFDAJMAFP-UHFFFAOYSA-N
Canonic Smiles
Fc1c(Cl)c(F)c(c(c1C(F)(F)F)F)Cl
Isomeric Smiles
c1(c(c(c(c(c1F)C(F)(F)F)F)Cl)F)Cl
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.4872894
LogD (pH = 7.4)
4.4872894
Log P
4.4872894
Molar Refractivity
42.2905
Polarizability
15.534263
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
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Molecular Spectra
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Molecule Details
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References
Bioactivity
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