Basic information
- CAS
101931-32-2- Standard SMILES
CC(=O)[O-].COc1ccc(C[NH3+])c2ccccc12- InChIKey
SAWBMWYRQLKNQC-UHFFFAOYSA-N- Molecular formula
- C14H17NO3
- Average molar mass
- 247.29 g/mol
- Monoisotopic mass
- 247.1208434
Names & identifiers
- Preferred name
- 1-Naphthalenemethylamine, 4-methoxy-, acetate
- IUPAC
- (4-methoxynaphthalen-1-yl)methylazanium acetate
Names & synonyms
4-Methoxy-1-naphthalenemethylamine, acetate1-NAPHTHALENEMETHYLAMINE, 4-METHOXY-, ACETATE101931-32-2DTXSID30144360RefChem:232297DTXCID7066851(4-methoxynaphthalen-1-yl)methanaminium acetate
Database identifiers
- CAS
101931-32-2- PubChem CID
- 59138
- DTXSID
DTXSID30144360
Properties
Computed structural properties
- Topological polar surface area
- 77 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 209
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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