Benzoic acid, p-ethoxy-, 2-(isopropylamino)ethyl ester, hydrochloride
Basic information
- CAS
92323-76-7- Standard SMILES
CCOc1ccc(C(=O)OCC[NH2+]C(C)C)cc1.[Cl-]- InChIKey
DHEQMLFROCGPJC-UHFFFAOYSA-N- Molecular formula
- C14H22ClNO3
- Average molar mass
- 287.78 g/mol
- Monoisotopic mass
- 287.1288213
Names & identifiers
- Preferred name
- Benzoic acid, p-ethoxy-, 2-(isopropylamino)ethyl ester, hydrochloride
- IUPAC
- 2-(4-ethoxybenzoyl)oxyethyl-propan-2-ylazanium chloride
Names & synonyms
p-Ethoxybenzoic acid 2-(isopropylamino)ethyl ester hydrochlorideBENZOIC ACID, p-ETHOXY-, 2-(ISOPROPYLAMINO)ETHYL ESTER, HYDROCHLORIDE92323-76-7RefChem:327935
Database identifiers
- CAS
92323-76-7- PubChem CID
- 56386
Properties
Computed structural properties
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 8
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 235
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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