Basic information
- Standard SMILES
[NH3+]CC(c1ccccc1)C1CCOCC1- InChIKey
MRBWEAQMVOBPNZ-UHFFFAOYSA-O- Molecular formula
- C13H20NO+
- Average molar mass
- 206.3 g/mol
- Monoisotopic mass
- 206.15448926
Names & identifiers
- Preferred name
- [2-(Oxan-4-yl)-2-phenylethyl]azanium
- IUPAC
- [2-(oxan-4-yl)-2-phenylethyl]azanium
Database identifiers
- PubChem CID
- 58415924
Properties
Computed structural properties
- XLogP
- 1.6
- Topological polar surface area
- 36.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 1
- Complexity
- 171
Related reactions
1 records
Compound notes
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