Basic information
- CAS
6967-04-0- Standard SMILES
Nc1ccc2c(c1)oc(=O)c1ccccc12- InChIKey
YQQVBNFLJJKBGW-UHFFFAOYSA-N- Molecular formula
- C13H9NO2
- Average molar mass
- 211.22 g/mol
- Monoisotopic mass
- 211.06332853
Overview
3-Amino-6H-dibenzo[b,d]pyran-6-one is a member of coumarins.
Names & identifiers
- Preferred name
- 3-Amino-6H-dibenzo[b,d]pyran-6-one
- IUPAC
- 3-aminobenzo[c]chromen-6-one
Names & synonyms
3-Amino-6H-dibenzo[b,d]pyran-6-one6967-04-03-AMINO-6H-BENZO[C]CHROMEN-6-ONE3-aminobenzo[c]chromen-6-oneSCHEMBL8236490SCHEMBL10507038SCHEMBL10855263CHEBI:79476DTXSID50989811NSC68246NSC-68246Q27148551
Database identifiers
- CAS
6967-04-0- PubChem CID
- 249674
- DTXSID
DTXSID50989811- ChEBI
CHEBI:79476- Nikkaji
- J2.161.707E
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 52.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 292
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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