Molecule

ID:98060

General Information
Structure
MolImage
Molecular Formula
C₁₀H₁₈F₆O₆S₂Si
Molecular Mass
440.4522392
Exact Mass
440.02182615
Charge
0
InChI
InChI=1S/C10H18F6O6S2Si/c1-7(2,3)25(8(4,5)6,21-23(17,18)9(11,12)13)22-24(19,20)10(14,15)16/h1-6H3
InChIKey
HUHKPYLEVGCJTG-UHFFFAOYSA-N
Canonic Smiles
CC([Si](C(C)(C)C)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F)(C)C
Isomeric Smiles
[Si](C(C)(C)C)(C(C)(C)C)(OS(=O)(=O)C(F)(F)F)OS(=O)(=O)C(F)(F)F
Calculated Properties
JChem
H Acceptors
4
H Donor
0
LogD (pH = 5.5)
5.4144
LogD (pH = 7.4)
5.4144
Log P
5.4144
Molar Refractivity
70.5396
Polarizability
31.440628
Polar Surface Area
86.74
Rotatable Bonds
8
Lipinski's Rule of Five
false
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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