Basic information
- CAS
47281-76-5- Standard SMILES
O=C1c2ccccc2C(=O)c2cc(N3C(=O)C=CC3=O)ccc21- InChIKey
JHEZJHRZAPMPGI-UHFFFAOYSA-N- Molecular formula
- C18H9NO4
- Average molar mass
- 303.3 g/mol
- Monoisotopic mass
- 303.05315777
Names & identifiers
- Preferred name
- 1-(9,10-Dioxo-9,10-dihydroanthracen-2-yl)-1h-pyrrole-2,5-dione
- IUPAC
- 1-(9,10-dioxoanthracen-2-yl)pyrrole-2,5-dione
Names & synonyms
47281-76-51-(9,10-dioxo-9,10-dihydroanthracen-2-yl)-1h-pyrrole-2,5-dioneNSC113492DTXSID40297058NSC-113492
Database identifiers
- CAS
47281-76-5- PubChem CID
- 270752
- DTXSID
DTXSID40297058
Properties
Computed structural properties
- XLogP
- 2
- Topological polar surface area
- 71.5 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 1
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 605
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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