Molecule

ID:93633

General Information
Structure
MolImage
Molecular Formula
C₉H₉F₅O₃Si
Molecular Mass
288.243476
Exact Mass
288.02411178
Charge
0
InChI
InChI=1S/C9H9F5O3Si/c1-15-18(16-2,17-3)9-7(13)5(11)4(10)6(12)8(9)14/h1-3H3
InChIKey
XFFHTZIRHGKTBQ-UHFFFAOYSA-N
Canonic Smiles
CO[Si](c1c(F)c(F)c(c(c1F)F)F)(OC)OC
Isomeric Smiles
[Si](c1c(c(c(c(c1F)F)F)F)F)(OC)(OC)OC
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
2.9198
LogD (pH = 7.4)
2.9198
Log P
2.9198
Molar Refractivity
47.697
Polarizability
20.101038
Polar Surface Area
27.69
Rotatable Bonds
4
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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