Basic information
- Standard SMILES
[NH3+]CCC(=O)c1ccccc1- InChIKey
HGZXQCCQZLSOPP-UHFFFAOYSA-O- Molecular formula
- C9H12NO+
- Average molar mass
- 150.2 g/mol
- Monoisotopic mass
- 150.09188901
Names & identifiers
- Preferred name
- (3-Oxo-3-phenylpropyl)azanium
- IUPAC
- (3-oxo-3-phenylpropyl)azanium
Database identifiers
- PubChem CID
- 6946996
Properties
Computed structural properties
- XLogP
- 0.7
- Topological polar surface area
- 44.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 11
- Formal charge
- 1
- Complexity
- 128
Related reactions
1 records
Compound notes
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