Basic information
- CAS
23958-98-7- Standard SMILES
CCOc1c(OC)cccc1C(=O)OCC[NH+](C)C.[Cl-]- InChIKey
YDQBNGBTJRHPQO-UHFFFAOYSA-N- Molecular formula
- C14H22ClNO4
- Average molar mass
- 303.78 g/mol
- Monoisotopic mass
- 303.1237359
Names & identifiers
- Preferred name
- 2-(Dimethylamino)ethyl 2-ethoxy-3-methoxybenzoate--hydrogen chloride (1/1)
- IUPAC
- 2-(2-ethoxy-3-methoxybenzoyl)oxyethyl-dimethylazanium chloride
Names & synonyms
23958-98-7DTXSID509467822-(Dimethylamino)ethyl 2-ethoxy-3-methoxybenzoate--hydrogen chloride (1/1)RefChem:1061787DTXCID001375056BENZOIC ACID, 2-ETHOXY-3-METHOXY-, 2-(DIMETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE2-Ethoxy-3-methoxybenzoic acid hydrochloride, 2-(dimethylamino)ethyl ester
Database identifiers
- CAS
23958-98-7- PubChem CID
- 32159
Properties
Computed structural properties
- Topological polar surface area
- 49.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 270
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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