Molecule
ID:10399
General Information
Molecular Formula
C₃H₃Cl₂F₃
Molecular Mass
166.9571296
Exact Mass
165.95639012
Charge
0
InChI
InChI=1S/C3H3Cl2F3/c4-1-2(5)3(6,7)8/h2H,1H2
InChIKey
QJMGASHUZRHZBT-UHFFFAOYSA-N
Canonic Smiles
ClCC(C(F)(F)F)Cl
Isomeric Smiles
FC(C(CCl)Cl)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.515368
LogD (pH = 7.4)
2.515368
Log P
2.515368
Molar Refractivity
25.7759
Polarizability
9.890429
Polar Surface Area
0.0
Rotatable Bonds
2
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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