Basic information
- Standard SMILES
COC(=O)c1sccc1C[P+](c1ccccc1)(c1ccccc1)c1ccccc1.[Br-]- InChIKey
BUFIOVAAJOTTMM-UHFFFAOYSA-M- Molecular formula
- C25H22BrO2PS
- Average molar mass
- 497.4 g/mol
- Monoisotopic mass
- 496.02615
Names & identifiers
- Preferred name
- 2-Methoxycarbonylthiophen-3-ylmethyltriphenylphosphonium bromide
- IUPAC
- (2-methoxycarbonylthiophen-3-yl)methyl-triphenylphosphanium bromide
Names & synonyms
SCHEMBL7833248BUFIOVAAJOTTMM-UHFFFAOYSA-M2-methoxycarbonylthiophen-3-ylmethyltriphenylphosphonium bromide
Database identifiers
- PubChem CID
- 19693052
Properties
Computed structural properties
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 475
Related reactions
1 records
Compound notes
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