Basic information
- CAS
89170-61-6- Standard SMILES
CC[N+](CC)(CCOc1ccccc1)Cc1ccccc1- InChIKey
BRKGCJJJVWWDSD-UHFFFAOYSA-N- Molecular formula
- C19H26NO+
- Average molar mass
- 284.4 g/mol
- Monoisotopic mass
- 284.20143945
Names & identifiers
- Preferred name
- Benzyl-diethyl-(2-phenoxyethyl)azanium
- IUPAC
- benzyl-diethyl-(2-phenoxyethyl)azanium
Names & synonyms
89170-61-6benzyl-diethyl-(2-phenoxyethyl)azaniumSCHEMBL9183119DTXSID50331351N-Benzyl-N,N-diethyl-2-phenoxyethan-1-aminium
Database identifiers
- CAS
89170-61-6- PubChem CID
- 437650
- DTXSID
DTXSID50331351
Properties
Computed structural properties
- XLogP
- 4.2
- Topological polar surface area
- 9.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 8
- Heavy atoms
- 21
- Formal charge
- 1
- Complexity
- 263
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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