Basic information
- CAS
342809-27-2- Standard SMILES
CCC(=O)[O-].c1ccc([S+](c2ccccc2)c2ccccc2)cc1- InChIKey
BVLKECPAIWFGHO-UHFFFAOYSA-M- Molecular formula
- C21H20O2S
- Average molar mass
- 336.4 g/mol
- Monoisotopic mass
- 336.11840088
Names & identifiers
- Preferred name
- Triphenylsulfanium propanoate
- IUPAC
- propanoate;triphenylsulfanium
Names & synonyms
Triphenylsulfanium propanoate342809-27-2triphenylsulfonium propionateSCHEMBL104393DTXSID00629437BVLKECPAIWFGHO-UHFFFAOYSA-M
Database identifiers
- CAS
342809-27-2- PubChem CID
- 22995017
- DTXSID
DTXSID00629437
Properties
Computed structural properties
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 236
Related reactions
2 records
Compound notes
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