Molecule

ID:99264

General Information
Structure
MolImage
Molecular Formula
C₅HClF₆
Molecular Mass
210.5048592
Exact Mass
209.96709703
Charge
0
InChI
InChI=1S/C5HClF6/c6-2-1-3(7,8)5(11,12)4(2,9)10/h1H
InChIKey
VJKCESNYEZQMBC-UHFFFAOYSA-N
Canonic Smiles
ClC1=CC(C(C1(F)F)(F)F)(F)F
Isomeric Smiles
ClC1=CC(F)(F)C(C1(F)F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.865907
LogD (pH = 7.4)
2.865907
Log P
2.865907
Molar Refractivity
29.0388
Polarizability
10.661021
Polar Surface Area
0.0
Rotatable Bonds
0
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
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References
Bioactivity
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