Molecule

ID:9736

General Information
Structure
MolImage
Molecular Formula
C₅H₉F₃O₄SSi
Molecular Mass
250.2682696
Exact Mass
249.99429096
Charge
0
InChI
InChI=1S/C5H9F3O4SSi/c1-14(2,3)12-4(9)5(6,7)13(8,10)11/h1-3H3
InChIKey
XHVSCKNABCCCAC-UHFFFAOYSA-N
Canonic Smiles
O=C(C(S(=O)(=O)F)(F)F)O[Si](C)(C)C
Isomeric Smiles
O=C(C(S(=O)(=O)F)(F)F)O[Si](C)(C)C
Calculated Properties
JChem
H Acceptors
3
H Donor
0
LogD (pH = 5.5)
2.1536
LogD (pH = 7.4)
2.1536
Log P
2.1536
Molar Refractivity
39.105
Polarizability
17.748545
Polar Surface Area
60.44
Rotatable Bonds
4
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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