Molecule

ID:98012

General Information
Structure
MolImage
Molecular Formula
C₆H₁₅BF₃KOSi
Molecular Mass
238.1727096
Exact Mass
238.05743837
Charge
0
InChI
InChI=1S/C6H15BF3OSi.K/c1-12(2,3)5-4-11-6-7(8,9)10;/h4-6H2,1-3H3;/q-1;+1
InChIKey
DJFAQXNICJQMDJ-UHFFFAOYSA-N
Canonic Smiles
C[Si](CCOC[B-](F)(F)F)(C)C.[K+]
Isomeric Smiles
[B-](F)(F)(F)COCC[Si](C)(C)C.[K+]
Calculated Properties
JChem
H Acceptors
1
H Donor
0
LogD (pH = 5.5)
2.5292
LogD (pH = 7.4)
2.5292
Log P
2.5292
Molar Refractivity
36.671
Polarizability
17.051065
Polar Surface Area
9.23
Rotatable Bonds
5
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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