Benzoic acid, 3,4,5-trimethoxy-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
Basic information
- CAS
4304-21-6- Standard SMILES
CC[NH+](CC)CCOC(=O)c1cc(OC)c(OC)c(OC)c1.[Cl-]- InChIKey
SLNGWZYXXOJBKC-UHFFFAOYSA-N- Molecular formula
- C16H26ClNO5
- Average molar mass
- 347.8 g/mol
- Monoisotopic mass
- 347.1499506
Names & identifiers
- Preferred name
- Benzoic acid, 3,4,5-trimethoxy-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)
- IUPAC
- diethyl-[2-(3,4,5-trimethoxybenzoyl)oxyethyl]azanium chloride
- English name
- 2-(diethylamino)ethyl 3,4,5-trimethoxybenzoate hydrochloride
- Molecular formula
- C16H26ClNO5
- Molecular weight
- 347.83434
Names & synonyms
4304-21-6RefChem:1079011Benzoic acid, 3,4,5-trimethoxy-, 2-(diethylamino)ethyl ester, hydrochloride (1:1)3,4,5-Trimethoxybenzoic acid 2-(diethylamino)ethyl ester hydrochlorideMcN-67-A-11NSC 28516BENZOIC ACID, 3,4,5-TRIMETHOXY-, 2-(DIETHYLAMINO)ETHYL ESTER, HYDROCHLORIDE3,4,5-Trimethoxybenzoic Acid 2-Diethylaminoethyl Ester HydrochlorideProparacaine Impurity 232-(diethylamino)ethyl 3,4,5-trimethoxybenzoate hydrochloride
Database identifiers
- CAS
4304-21-6- PubChem CID
- 20291
Properties
Computed structural properties
- Topological polar surface area
- 58.4 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 10
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 308
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Compound notes
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