Basic information
- Standard SMILES
COC(=O)c1sccc1C[P+](c1ccccc1)(c1ccccc1)c1ccccc1- InChIKey
DBBBNXOXUKSAFI-UHFFFAOYSA-N- Molecular formula
- C25H22O2PS+
- Average molar mass
- 417.5 g/mol
- Monoisotopic mass
- 417.10781311
Names & identifiers
- Preferred name
- (2-Methoxycarbonylthiophen-3-yl)methyl-triphenylphosphanium
- IUPAC
- (2-methoxycarbonylthiophen-3-yl)methyl-triphenylphosphanium
Database identifiers
- PubChem CID
- 19693053
Properties
Computed structural properties
- XLogP
- 6
- Topological polar surface area
- 54.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 7
- Heavy atoms
- 29
- Formal charge
- 1
- Complexity
- 475
Related reactions
1 records
Compound notes
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