Molecule

ID:99237

General Information
Structure
MolImage
Molecular Formula
C₂HF₄I
Molecular Mass
227.9274228
Exact Mass
227.90591091
Charge
0
InChI
InChI=1S/C2HF4I/c3-1(4)2(5,6)7/h1H
InChIKey
PIFDIGQPGUUCSG-UHFFFAOYSA-N
Canonic Smiles
FC(C(I)(F)F)F
Isomeric Smiles
FC(F)C(F)(I)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.515
LogD (pH = 7.4)
1.515
Log P
1.515
Molar Refractivity
24.9542
Polarizability
9.989549
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
No Data Available
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Molecular Spectra
No Data Available
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Molecule Details
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References
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Bioactivity
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