Molecule

ID:10400

General Information
Structure
MolImage
Molecular Formula
C₂HCl₃F₂
Molecular Mass
169.3851464
Exact Mass
167.91118951
Charge
0
InChI
InChI=1S/C2HCl3F2/c3-1(4)2(5,6)7/h1H
InChIKey
FQAMAOOEZDRHHB-UHFFFAOYSA-N
Canonic Smiles
ClC(C(Cl)(F)F)Cl
Isomeric Smiles
FC(C(Cl)Cl)(Cl)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.666498
LogD (pH = 7.4)
2.666498
Log P
2.666498
Molar Refractivity
26.6513
Polarizability
10.136366
Polar Surface Area
0.0
Rotatable Bonds
1
Lipinski's Rule of Five
true
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
References
Bioactivity
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