6-Bromo-4,4-dihexyl-4H-silolo[3,2-b:4,5-b']dithiophene-2-carbaldehyde
Basic information
- CAS
1192035-50-9- Standard SMILES
CCCCCC[Si]1(CCCCCC)c2cc(Br)sc2-c2sc(C=O)cc21- InChIKey
PGVFNYURLJVBFX-UHFFFAOYSA-N- Molecular formula
- C21H29BrOS2Si
- Average molar mass
- 469.6 g/mol
Names & identifiers
- Preferred name
- 6-Bromo-4,4-dihexyl-4H-silolo[3,2-b:4,5-b']dithiophene-2-carbaldehyde
- IUPAC
- 10-bromo-7,7-dihexyl-3,11-dithia-7-silatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene-4-carbaldehyde
- English name
- 4H-Silolo[3,2-b:4,5-b']dithiophene-2-carboxaldehyde, 6-bromo-4,4-dihexyl-
- Molecular formula
- C21H29BrOS2Si
- Molecular weight
- 469.57
Names & synonyms
1192035-50-96-Bromo-4,4-dihexyl-4H-silolo[3,2-b:4,5-b']dithiophene-2-carbaldehyde10-bromo-7,7-dihexyl-3,11-dithia-7-silatricyclo[6.3.0.02,6]undeca-1(8),2(6),4,9-tetraene-4-carbaldehyde4H-Silolo[3,2-b:4,5-b']dithiophene-2-carboxaldehyde, 6-bromo-4,4-dihexyl-
Database identifiers
- CAS
1192035-50-9
Properties
Computed structural properties
- Topological polar surface area
- 73.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 11
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 451
Physicochemical properties
- Boiling point
- 531.5 · 531.5±50.0 °C(Predicted)
- Density
- 1.27 · 1.27±0.1 g/cm3(Predicted)
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Compound notes
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