Molecule

ID:7026

General Information
Structure
MolImage
Molecular Formula
C₂ClF₄I
Molecular Mass
262.3724828
Exact Mass
261.86693856
Charge
0
InChI
InChI=1S/C2ClF4I/c3-1(4,8)2(5,6)7
InChIKey
DZIPETVAKXQJPX-UHFFFAOYSA-N
Canonic Smiles
FC(C(F)(F)F)(I)Cl
Isomeric Smiles
C(C(F)(I)Cl)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.5763
LogD (pH = 7.4)
2.5763
Log P
2.5763
Molar Refractivity
30.7624
Polarizability
11.960504
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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