Basic information
- Standard SMILES
Cc1ccc(S(=O)(=O)[O-])cc1.N#Cc1ccc2c(c1)CCC(C[P+](c1ccccc1)(c1ccccc1)c1ccccc1)C2- InChIKey
UMZXNHUGTVRBCU-UHFFFAOYSA-M- Molecular formula
- C37H34NO3PS
- Average molar mass
- 603.7 g/mol
Names & identifiers
- Preferred name
- (6-Cyano-1,2,3,4-tetrahydro-2-naphthyl)methyltriphenylphosphonium p-toluenesulfonate
- IUPAC
- (6-cyano-1,2,3,4-tetrahydronaphthalen-2-yl)methyl-triphenylphosphanium;4-methylbenzenesulfonate
Names & synonyms
SCHEMBL7389074UMZXNHUGTVRBCU-UHFFFAOYSA-M(6-Cyano-1,2,3,4-tetrahydro-2-naphthyl)methyltriphenylphosphonium p-Toluene Sulfonate(6-cyano-1,2,3,4-tetrahydro-2-naphthyl)methyltriphenylphosphonium p-toluenesulfonate
Database identifiers
- PubChem CID
- 21844271
Properties
Computed structural properties
- Topological polar surface area
- 89.4 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 43
- Formal charge
- 0
- Complexity
- 778
Related reactions
5 records
Compound notes
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