Basic information
- CAS
93086-58-9- Standard SMILES
CCOc1ccc(C(=O)OCC[NH2+]C)cc1.[Cl-]- InChIKey
DPUFJYCTNUHJDO-UHFFFAOYSA-N- Molecular formula
- C12H18ClNO3
- Average molar mass
- 259.73 g/mol
- Monoisotopic mass
- 259.0975211
Names & identifiers
- Preferred name
- 2-(Methylamino)ethyl 4-ethoxybenzoate--hydrogen chloride (1/1)
- IUPAC
- 2-(4-ethoxybenzoyl)oxyethyl-methylazanium chloride
Names & synonyms
93086-58-9DTXSID709187242-(Methylamino)ethyl 4-ethoxybenzoate--hydrogen chloride (1/1)RefChem:1061895DTXCID901347670p-Ethoxybenzoic acid, 2-(methylamino)ethyl ester hydrochlorideBENZOIC ACID, p-ETHOXY-, 2-(METHYLAMINO)ETHYL ESTER, HYDROCHLORIDE
Database identifiers
- CAS
93086-58-9- PubChem CID
- 56534
Properties
Computed structural properties
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 7
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 200
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…