Basic information
- CAS
27500-39-6- Standard SMILES
CN(C)Cc1c(O)ccc2c(=O)cc(-c3ccccc3)oc12- InChIKey
CTTNILKNJDAMIA-UHFFFAOYSA-N- Molecular formula
- C18H17NO3
- Average molar mass
- 295.3 g/mol
- Monoisotopic mass
- 295.1208434
Names & identifiers
- Preferred name
- 4H-1-Benzopyran-4-one, 8-[(dimethylamino)methyl]-7-hydroxy-2-phenyl-
- IUPAC
- 8-[(dimethylamino)methyl]-7-hydroxy-2-phenylchromen-4-one
Names & synonyms
27500-39-68-((Dimethylamino)methyl)-7-hydroxy-2-phenyl-4H-chromen-4-one8-[(dimethylamino)methyl]-7-hydroxy-2-phenyl-4h-chromen-4-one4H-1-Benzopyran-4-one, 8-[(dimethylamino)methyl]-7-hydroxy-2-phenyl-DTXSID502755498-[(Dimethylamino)methyl]-7-hydroxy-2-phenyl-4H-1-benzopyran-4-one
Database identifiers
- CAS
27500-39-6- PubChem CID
- 49680
- DTXSID
DTXSID50275549
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 440
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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