2-Benzofurancarboxylic acid, 6-methoxy-3-methyl-, diethylaminoethyl ester, hydrochloride
Basic information
- CAS
35689-36-2- Standard SMILES
CC[NH+](CC)CCOC(=O)c1oc2cc(OC)ccc2c1C.[Cl-]- InChIKey
IGKVYOLVLMNGBD-UHFFFAOYSA-N- Molecular formula
- C17H24ClNO4
- Average molar mass
- 341.8 g/mol
- Monoisotopic mass
- 341.1393859
Names & identifiers
- Preferred name
- 2-Benzofurancarboxylic acid, 6-methoxy-3-methyl-, diethylaminoethyl ester, hydrochloride
- IUPAC
- diethyl-[2-(6-methoxy-3-methyl-1-benzofuran-2-carbonyl)oxyethyl]azanium chloride
Names & synonyms
2-Benzofurancarboxylic acid, 6-methoxy-3-methyl-, diethylaminoethyl ester, hydrochloride35689-36-2RefChem:10623196-Methoxy-3-methyl-2-benzofurancarboxylic acid diethylaminoethyl ester hydrochloride
Database identifiers
- CAS
35689-36-2- PubChem CID
- 37228
Properties
Computed structural properties
- Topological polar surface area
- 53.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 8
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 359
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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