Molecule

ID:7038

General Information
Structure
MolImage
Molecular Formula
C₆HClF₄
Molecular Mass
184.5187528
Exact Mass
183.97029059
Charge
0
InChI
InChI=1S/C6HClF4/c7-4-5(10)2(8)1-3(9)6(4)11/h1H
InChIKey
QLDHPPIOYFTGAJ-UHFFFAOYSA-N
Canonic Smiles
Fc1cc(F)c(c(c1F)Cl)F
Isomeric Smiles
c1(cc(c(c(c1F)Cl)F)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.1480982
LogD (pH = 7.4)
3.1480982
Log P
3.1480982
Molar Refractivity
31.7284
Polarizability
11.652518
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
true
Data Source
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Names and Identifiers
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Registration numbers
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Properties
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Related Proteins
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Molecular Spectra
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Molecule Details
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References
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Bioactivity
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