Basic information
- CAS
112104-43-5- Standard SMILES
Nc1oc2c(oc3ccccc32)c(=O)c1-c1ccccc1- InChIKey
MNQONVLEBUVOHQ-UHFFFAOYSA-N- Molecular formula
- C17H11NO3
- Average molar mass
- 277.27 g/mol
- Monoisotopic mass
- 277.07389321
Names & identifiers
- Preferred name
- 2-amino-3-phenyl-4H-pyrano[3,2-b]benzofuran-4-one
- IUPAC
- 2-amino-3-phenylpyrano[3,2-b][1]benzofuran-4-one
Names & synonyms
2-amino-3-phenyl-4H-pyrano[3,2-b]benzofuran-4-one112104-43-5DTXSID2012338722-Amino-3-phenyl-4H-pyrano[3,2-b][1]benzofuran-4-one
Database identifiers
- CAS
112104-43-5- PubChem CID
- 13683050
- DTXSID
DTXSID201233872
Properties
Computed structural properties
- XLogP
- 3.4
- Topological polar surface area
- 65.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 467
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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