Molecule

ID:9468

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₃F₆PS
Molecular Mass
310.2394002
Exact Mass
310.03797737
Charge
0
InChI
InChI=1S/C10H13S.F6P/c1-2-6-10(7-3-1)11-8-4-5-9-11;1-7(2,3,4,5)6/h1-3,6-7H,4-5,8-9H2;/q+1;-1
InChIKey
FJBXYJIIZVQTSF-UHFFFAOYSA-N
Canonic Smiles
C1CC[S+](C1)c1ccccc1.F[P-](F)(F)(F)(F)F
Isomeric Smiles
c1cccc(c1)[S+]1CCCC1.F[P-](F)(F)(F)(F)F
Calculated Properties
JChem
H Acceptors
0
H Donor
0
LogD (pH = 5.5)
1.4676354
LogD (pH = 7.4)
1.4676354
Log P
1.4676354
Molar Refractivity
49.9677
Polarizability
20.368515
Polar Surface Area
0.0
Rotatable Bonds
1
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
No Data Available
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Molecule Details
References
Bioactivity
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