2-(Dimethylamino)ethyl 5-bromo-6-methoxy-3-methyl-1-benzofuran-2-carboxylate;hydrochloride
Basic information
- CAS
35689-37-3- Standard SMILES
COc1cc2oc(C(=O)OCCN(C)C)c(C)c2cc1Br.Cl- InChIKey
QVKNWTRXNGCDNR-UHFFFAOYSA-N- Molecular formula
- C15H19BrClNO4
- Average molar mass
- 392.67 g/mol
- Monoisotopic mass
- 391.0186
Overview
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Names & identifiers
- Preferred name
- 2-(Dimethylamino)ethyl 5-bromo-6-methoxy-3-methyl-1-benzofuran-2-carboxylate;hydrochloride
- IUPAC
- 2-(dimethylamino)ethyl 5-bromo-6-methoxy-3-methyl-1-benzofuran-2-carboxylate;hydrochloride
Names & synonyms
2-(dimethylamino)ethyl 5-bromo-6-methoxy-3-methyl-1-benzofuran-2-carboxylate hydrochlorideDTXSID309570732-(dimethylamino)ethyl 5-bromo-6-methoxy-3-methyl-1-benzofuran-2-carboxylate;hydrochloride2-(Dimethylamino)ethyl 5-bromo-6-methoxy-3-methyl-1-benzofuran-2-carboxylate--hydrogen chloride (1/1)
Database identifiers
- CAS
35689-37-3- PubChem CID
- 45926273
- DTXSID
DTXSID30957073
Properties
Computed structural properties
- Topological polar surface area
- 51.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 366
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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