Molecule

ID:10763

General Information
Structure
MolImage
Molecular Formula
C₂H₂ClF₃
Molecular Mass
118.4854896
Exact Mass
117.9797124
Charge
0
InChI
InChI=1S/C2H2ClF3/c3-1-2(4,5)6/h1H2
InChIKey
CYXIKYKBLDZZNW-UHFFFAOYSA-N
Canonic Smiles
ClCC(F)(F)F
Isomeric Smiles
C(CCl)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.791111
LogD (pH = 7.4)
1.791111
Log P
1.791111
Molar Refractivity
16.7624
Polarizability
6.2233806
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
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Molecule Details
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References
Bioactivity
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