Basic information
- Standard SMILES
CCOC1=[N+](Cc2ccccc2)CCC1- InChIKey
UAWUQFJDTCENRW-UHFFFAOYSA-N- Molecular formula
- C13H18NO+
- Average molar mass
- 204.29 g/mol
- Monoisotopic mass
- 204.1388392
Names & identifiers
- Preferred name
- 1-benzyl-5-ethoxy-3,4-dihydro-2H-pyrrol-1-ium
- IUPAC
- 1-benzyl-5-ethoxy-3,4-dihydro-2H-pyrrol-1-ium
Database identifiers
- PubChem CID
- 57795048
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 12.2 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 4
- Heavy atoms
- 15
- Formal charge
- 1
- Complexity
- 229
Related reactions
2 records
Linked notes
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