6-Benzofuranol, 7-((dimethylamino)methyl)-3-phenyl-, hydrochloride
Basic information
- CAS
63112-46-9- Standard SMILES
C[NH+](C)Cc1c(O)ccc2c(-c3ccccc3)coc12.[Cl-]- InChIKey
BNGVRIJKXILXGO-UHFFFAOYSA-N- Molecular formula
- C17H18ClNO2
- Average molar mass
- 303.8 g/mol
- Monoisotopic mass
- 303.1026065
Names & identifiers
- Preferred name
- 6-Benzofuranol, 7-((dimethylamino)methyl)-3-phenyl-, hydrochloride
- IUPAC
- (6-hydroxy-3-phenyl-1-benzofuran-7-yl)methyl-dimethylazanium chloride
Names & synonyms
7-((Dimethylamino)methyl)-3-phenyl-6-benzofuranol hydrochloride3-Phenyl-6-hydroxy-7-dimethylaminomethylbenzofuran hydrochloride6-BENZOFURANOL, 7-((DIMETHYLAMINO)METHYL)-3-PHENYL-, HYDROCHLORIDE63112-46-9RefChem:307229
Database identifiers
- CAS
63112-46-9- PubChem CID
- 44398
Properties
Computed structural properties
- Topological polar surface area
- 37.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 314
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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