7H-Furo(3,2-g)(1)benzopyran-7-one, 4-((dimethylamino)methyl)-9-methoxy-, hydrochloride
Basic information
- CAS
96616-38-5- Standard SMILES
COc1c2occc2c(CN(C)C)c2ccc(=O)oc12.Cl- InChIKey
ATNDXVOFIWJDGT-UHFFFAOYSA-N- Molecular formula
- C15H16ClNO4
- Average molar mass
- 309.74 g/mol
- Monoisotopic mass
- 309.0767857
Names & identifiers
- Preferred name
- 7H-Furo(3,2-g)(1)benzopyran-7-one, 4-((dimethylamino)methyl)-9-methoxy-, hydrochloride
- IUPAC
- 4-[(dimethylamino)methyl]-9-methoxyfuro[3,2-g]chromen-7-one;hydrochloride
Names & synonyms
7H-Furo(3,2-g)(1)benzopyran-7-one, 4-((dimethylamino)methyl)-9-methoxy-, hydrochloride96616-38-54-((Dimethylamino)methyl)-9-methoxy-7H-furo(3,2-g)(1)benzopyran-7-one hydrochlorideCHEMBL267498DTXSID802423654-[(Dimethylamino)methyl]-9-methoxy-7H-furo[3,2-g][1]benzopyran-7-one--hydrogen chloride (1/1)
Database identifiers
- CAS
96616-38-5- PubChem CID
- 150431
- DTXSID
DTXSID80242365- ChEMBL
CHEMBL267498
Properties
Computed structural properties
- Topological polar surface area
- 51.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 409
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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