Molecule

ID:98567

General Information
Structure
MolImage
Molecular Formula
C₆H₄Cl₂F₆
Molecular Mass
260.9923792
Exact Mass
259.95942481
Charge
0
InChI
InChI=1S/C6H4Cl2F6/c7-3(2-5(9,10)11)1-4(8)6(12,13)14/h1,3H,2H2
InChIKey
VDWLGNLWODLYEN-UHFFFAOYSA-N
Canonic Smiles
ClC(CC(F)(F)F)/C=C(/C(F)(F)F)\Cl
Isomeric Smiles
FC(CC(/C=C(/C(F)(F)F)\Cl)Cl)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.429433
LogD (pH = 7.4)
3.429433
Log P
3.429433
Molar Refractivity
41.3693
Polarizability
14.939504
Polar Surface Area
0.0
Rotatable Bonds
4
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
No Data Available
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Molecule Details
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References
Bioactivity
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