2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone
Basic information
- CAS
22950-50-1- Standard SMILES
COC(CC[P+](c1ccccc1)(c1ccccc1)c1ccccc1)(C(=O)c1ccccc1)c1ccccc1- InChIKey
UERYBYTVDBNLTR-UHFFFAOYSA-N- Molecular formula
- C35H32O2P+
- Average molar mass
- 515.6 g/mol
- Monoisotopic mass
- 515.21399226
Names & identifiers
- Preferred name
- 2-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanone
- IUPAC
- (3-methoxy-4-oxo-3,4-diphenylbutyl)-triphenylphosphanium
Names & synonyms
22950-50-12-Methoxy-1,2-diphenyl-4-(triphenylphosphoranyl)-1-butanoneNSC 123167NSC123167(3-methoxy-4-oxo-3,4-diphenyl-butyl)-triphenyl-phosphonium
Database identifiers
- CAS
22950-50-1- PubChem CID
- 494113
Properties
Computed structural properties
- XLogP
- 7.8
- Topological polar surface area
- 26.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 10
- Heavy atoms
- 38
- Formal charge
- 1
- Complexity
- 660
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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