Molecule
ID:99662
General Information
Molecular Formula
C₃H₂Cl₂F₂
Molecular Mass
146.9507864
Exact Mass
145.95016186
Charge
0
InChI
InChI=1S/C3H2Cl2F2/c4-2(5)1-3(6)7/h1-2H
InChIKey
OBFAQBSZUXJMSP-UHFFFAOYSA-N
Canonic Smiles
ClC(C=C(F)F)Cl
Isomeric Smiles
FC(=CC(Cl)Cl)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.4151149
LogD (pH = 7.4)
2.4151149
Log P
2.4151149
Molar Refractivity
36.6587
Polarizability
9.612595
Polar Surface Area
0.0
Rotatable Bonds
1
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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