Basic information
- CAS
6470-90-2- Standard SMILES
O=C(Nc1ccc2c(c1)C(=O)c1ccc(NC(=O)c3ccccc3)cc1C2=O)c1ccccc1- InChIKey
BEGIKIVKUQSREV-UHFFFAOYSA-N- Molecular formula
- C28H18N2O4
- Average molar mass
- 446.5 g/mol
- Monoisotopic mass
- 446.12665706
Names & identifiers
- Preferred name
- N,N'-(9,10-Dihydro-9,10-dioxoanthracene-2,6-diyl)bisbenzamide
- IUPAC
- N-(6-benzamido-9,10-dioxoanthracen-2-yl)benzamide
- English name
- N,N'-(9,10-dihydro-9,10-dioxoanthracene-2,6-diyl)bisbenzamide
- Molecular formula
- C28H18N2O4
- Molecular weight
- 446.45
Names & synonyms
6470-90-2N,N'-(9,10-Dihydro-9,10-dioxoanthracene-2,6-diyl)bisbenzamiden,n'-(9,10-dioxo-9,10-dihydroanthracene-2,6-diyl)dibenzamideN-(6-benzamido-9,10-dioxoanthracen-2-yl)benzamideEINECS 229-300-12,6-dibenzamidoanthraquinoneSCHEMBL25970373DTXSID90983338BEGIKIVKUQSREV-UHFFFAOYSA-NAKOS024422559NS00047212N,N'-(9,10-Dioxo-9,10-dihydroanthracene-2,6-diyl)dibenzenecarboximidic acid
Show more names
2,6-Bis(benzoylamino)anthraquinone2,6-Bis(benzoylamino)-9,10-anthraquinoneBenzamide, N,N'-(9,10-dihydro-9,10-dioxo-2,6-anthracenediyl)bis-
N-[6-(BENZOYLAMINO)-9,10-DIOXO-9,10-DIHYDRO-2-ANTHRACENYL]BENZAMIDE
Database identifiers
- CAS
6470-90-2- PubChem CID
- 80951
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 34
- Formal charge
- 0
- Complexity
- 732
Physicochemical properties
- Melting point
- 300 °C · 300 °C
- Boiling point
- 561.9 · 561.9±50.0 °C(Predicted)
- Density
- 1.409 · 1.409±0.06 g/cm3(Predicted)
- pka
- 12.11 · 12.11±0.20(Predicted)
Chemistry & industry
Upstream & downstream products
Downstream products
Suppliers2 total
吉林中科研伸科技有限公司18143011203 · [email protected]
Jilin Chinese Academy of Sciences-yanshen Technology18143011203 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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