Molecule

ID:9798

General Information
Structure
MolImage
Molecular Formula
C₁₄H₆F₈
Molecular Mass
326.1846656
Exact Mass
326.03417595
Charge
0
InChI
InChI=1S/C14H6F8/c1-3-7(15)11(19)5(12(20)8(3)16)6-13(21)9(17)4(2)10(18)14(6)22/h1-2H3
InChIKey
IMAVLXWSVGAOCU-UHFFFAOYSA-N
Canonic Smiles
Fc1c(c2c(F)c(F)c(c(c2F)F)C)c(F)c(c(c1F)C)F
Isomeric Smiles
c1(F)c(c(F)c(c(c1F)C)F)c1c(F)c(F)c(c(c1F)F)C
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
5.7889295
LogD (pH = 7.4)
5.7889295
Log P
5.7889295
Molar Refractivity
63.0078
Polarizability
22.994162
Polar Surface Area
0.0
Rotatable Bonds
0
Lipinski's Rule of Five
false
Data Source
Names and Identifiers
Registration numbers
Properties
Related Proteins
No Data Available
Click here to submit data
Molecular Spectra
No Data Available
Click here to submit data
Molecule Details
References
Bioactivity
Navigation