Molecule

ID:7772

General Information
Structure
Molecular Formula
C₄H₂F₈
Molecular Mass
202.0459056
Exact Mass
202.00287582
Charge
0
InChI
InChI=1S/C4H2F8/c5-1(6)3(9,10)4(11,12)2(7)8/h1-2H
InChIKey
LKLFXAVIFCLZQS-UHFFFAOYSA-N
Canonic Smiles
FC(C(C(C(F)F)(F)F)(F)F)F
Isomeric Smiles
C(C(C(C(F)F)(F)F)(F)F)(F)F
Calculated Properties
JChem
Acid pKa
19.495363
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
2.505482
LogD (pH = 7.4)
2.505482
Log P
2.505482
Molar Refractivity
20.4258
Polarizability
8.225123
Polar Surface Area
0.0
Rotatable Bonds
3
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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