Molecule

ID:98136

General Information
Structure
Molecular Formula
C₅ClF₉
Molecular Mass
266.4921288
Exact Mass
265.95448166
Charge
0
InChI
InChI=1S/C5ClF9/c6-1(7)2(8,9)4(12,13)5(14,15)3(1,10)11
InChIKey
MYVQKOLPIBOMHY-UHFFFAOYSA-N
Canonic Smiles
FC1(F)C(F)(Cl)C(C(C1(F)F)(F)F)(F)F
Isomeric Smiles
FC1(C(C(F)(F)C(C1(Cl)F)(F)F)(F)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
3.9366407
LogD (pH = 7.4)
3.9366407
Log P
3.9366407
Molar Refractivity
28.2585
Polarizability
11.342479
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
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Molecule Details
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References
Bioactivity
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