Molecule

ID:32021

General Information
Structure
MolImage
Molecular Formula
C₉H₄F₈
Molecular Mass
264.1152856
Exact Mass
264.01852589
Charge
0
InChI
InChI=1S/C9H4F8/c10-4-3(1-2-9(15,16)17)5(11)7(13)8(14)6(4)12/h1-2H2
InChIKey
FMUPCXGYMFKRMJ-UHFFFAOYSA-N
Canonic Smiles
Fc1c(CCC(F)(F)F)c(F)c(c(c1F)F)F
Isomeric Smiles
c1(c(c(c(c(c1CCC(F)(F)F)F)F)F)F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
4.2794757
LogD (pH = 7.4)
4.2794757
Log P
4.2794757
Molar Refractivity
42.1665
Polarizability
14.839327
Polar Surface Area
0.0
Rotatable Bonds
3
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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