Silane, ((4-(4-(4-fluorophenyl)-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)phenyl)ethynyl)trimethyl-
Basic information
- CAS
131505-62-9- Standard SMILES
C[Si](C)(C)C#Cc1ccc(C23OCC(c4ccc(F)cc4)(CO2)CO3)cc1- InChIKey
PUWWALUDNDSLAJ-UHFFFAOYSA-N- Molecular formula
- C22H23FO3Si
- Average molar mass
- 382.5 g/mol
- Monoisotopic mass
- 382.14004929
Names & identifiers
- Preferred name
- Silane, ((4-(4-(4-fluorophenyl)-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)phenyl)ethynyl)trimethyl-
- IUPAC
- 2-[4-[4-(4-fluorophenyl)-2,6,7-trioxabicyclo[2.2.2]octan-1-yl]phenyl]ethynyl-trimethylsilane
Names & synonyms
Silane, ((4-(4-(4-fluorophenyl)-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)phenyl)ethynyl)trimethyl-((4-(4-(4-Fluorophenyl)-2,6,7-trioxabicyclo(2.2.2)oct-1-yl)phenyl)ethynyl)trimethylsilane131505-62-9DTXSID60157089RefChem:380212DTXCID2079580SCHEMBL9451685({4-[4-(4-Fluorophenyl)-2,6,7-trioxabicyclo[2.2.2]octan-1-yl]phenyl}ethynyl)tri(methyl)silane
Database identifiers
- CAS
131505-62-9- PubChem CID
- 3076501
- DTXSID
DTXSID60157089
Properties
Computed structural properties
- Topological polar surface area
- 27.7 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 27
- Formal charge
- 0
- Complexity
- 575
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Compound notes
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