Basic information
- Standard SMILES
Fc1ccc2sc(C[P+](c3ccccc3)(c3ccccc3)c3ccccc3)nc2c1- InChIKey
BOKBPYFRDFROQE-UHFFFAOYSA-N- Molecular formula
- C26H20FNPS+
- Average molar mass
- 428.5 g/mol
Names & identifiers
- Preferred name
- (5-Fluoro-1,3-benzothiazol-2-yl)methyl-triphenylphosphanium
- IUPAC
- (5-fluoro-1,3-benzothiazol-2-yl)methyl-triphenylphosphanium
Names & synonyms
SCHEMBL27348540
Database identifiers
- PubChem CID
- 19019463
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 41.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 30
- Formal charge
- 1
- Complexity
- 496
Related reactions
2 records
Compound notes
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