Basic information
- CAS
23959-28-6- Standard SMILES
CCN(CC)CCOC(=O)c1cccc(OC)c1OC.Cl- InChIKey
FPPVUXBASWMIBH-UHFFFAOYSA-N- Molecular formula
- C15H24ClNO4
- Average molar mass
- 317.81 g/mol
- Monoisotopic mass
- 317.1393859
Names & identifiers
- Preferred name
- 2-(Diethylamino)ethyl 2,3-dimethoxybenzoate--hydrogen chloride (1/1)
- IUPAC
- 2-(diethylamino)ethyl 2,3-dimethoxybenzoate;hydrochloride
Names & synonyms
23959-28-6DTXSID109467882-(Diethylamino)ethyl 2,3-dimethoxybenzoate--hydrogen chloride (1/1)RefChem:1061635DTXCID801375062o-Veratric acid hydrochloride, 2-(diethylamino)ethyl estero-Veratric acid, 2-(diethylamino)ethyl ester, hydrochloride2,3-Dimethoxybenzoic acid hydrochloride, 2-(diethylamino)ethyl esterBenzoic acid, 2,3-dimethoxy-, 2-(diethylamino)ethyl ester, hydrochloride
Database identifiers
- CAS
23959-28-6- PubChem CID
- 90306
- DTXSID
DTXSID10946788
Properties
Computed structural properties
- Topological polar surface area
- 48 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 9
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 281
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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