Molecule

ID:97933

General Information
Structure
MolImage
Molecular Formula
C₈H₆Cl₂F₂
Molecular Mass
211.0360464
Exact Mass
209.98146199
Charge
0
InChI
InChI=1S/C8H6Cl2F2/c1-8(11,12)5-2-3-6(9)7(10)4-5/h2-4H,1H3
InChIKey
MQZFHEVMCSILDA-UHFFFAOYSA-N
Canonic Smiles
Clc1ccc(cc1Cl)C(F)(F)C
Isomeric Smiles
FC(c1cc(c(cc1)Cl)Cl)(C)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.818486
LogD (pH = 7.4)
3.818486
Log P
3.818486
Molar Refractivity
45.7734
Polarizability
17.380808
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
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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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