Basic information
- CAS
5656-82-6- Standard SMILES
O=C1c2ccccc2C(=O)c2occc21- InChIKey
QMKMOPXRLXYBLI-UHFFFAOYSA-N- Molecular formula
- C12H6O3
- Average molar mass
- 198.17 g/mol
- Monoisotopic mass
- 198.03169405
Overview
Naphtho(2,3-b)furan-4,9-dione has been reported in Avicennia alba with data available.
Names & identifiers
- Preferred name
- Naphtho(2,3-b)furan-4,9-dione
- IUPAC
- benzo[f][1]benzofuran-4,9-dione
- English name
- naphtho(2,3-b)furan-4,9-dione
- Molecular formula
- C12H6O3
- Molecular weight
- 198.17
Names & synonyms
Naphtho[2,3-b]furan-4,9-dione5656-82-6benzo[f][1]benzofuran-4,9-dioneNpf-4,9-dioneNaphtho(2,3-b)furan-4,9-dioneDTXSID00205114benzo(f)(1)benzofuran-4,9-dioneRefChem:164725DTXCID001276054H,9H-NAPHTHO[2,3-B]FURAN-4,9-DIONESCHEMBL28782CHEMBL62539
Show more names
Avicequinone B4,9-Dihydronaphtho[2,3-b]furan-4,9-dione
SCHEMBL29364602Furan, 2,3-(1,2-phenylenedicarbonyl)-
Database identifiers
- CAS
5656-82-6- PubChem CID
- 79740
- DTXSID
DTXSID00205114- ChEMBL
CHEMBL62539- Nikkaji
- J132.848D
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 47.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 0
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 310
Related reactions
2 records
Compound notes
Loading…