Basic information
- CAS
81-46-9- Standard SMILES
Nc1ccc(NC(=O)c2ccccc2)c2c1C(=O)c1ccccc1C2=O- InChIKey
PXNNPGGYHAWDJW-UHFFFAOYSA-N- Molecular formula
- C21H14N2O3
- Average molar mass
- 342.3 g/mol
- Monoisotopic mass
- 342.10044231
Overview
N-(4-amino-9,10-dioxo-1-anthracenyl)benzamide is an anthraquinone.
Names & identifiers
- Preferred name
- Corinth flour
- IUPAC
- N-(4-amino-9,10-dioxoanthracen-1-yl)benzamide
- English name
- 1-Amino-4-benzamidoanthraquinone
- Molecular formula
- C21H14N2O3
- Molecular weight
- 342.35
Names & synonyms
1-Amino-4-benzamidoanthraquinone81-46-9Corinth flour4-Amino-1-benzoylaminoanthraquinoneAnthraquinone, 1-amino-4-benzamido-N-(4-Aminoanthraquinonyl)benzamideBenzamide, N-(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)-Benzamide, N-(4-amino-1-anthraquinonyl)-NSC 139821-Amino-4-(benzoylamino)anthraquinoneEINECS 201-351-4BRN 2224877
Show more names
Corinth Fluor1-BENZOYLAMINOANTHRAQUINONE1-amino-4-benzamido-anthraquinon1-BENZAMIDO-4-ANTHRAQUINONYLAMINE4-AMINO-1-BENZOYLAMINOATHRAQUINONE
1-Amino-4-benzoylaminoanthrachinon [Czech]1-Amino-4-benzoylaminoanthrachinonDTXSID6058847RefChem:579213DTXCID90481941-Amino-4-benzoylaminoanthraquinoneN-(4-amino-9,10-dioxoanthracen-1-yl)benzamideN-(4-Amino-9,10-dihydro-9,10-dioxo-1-anthryl)benzamide
Database identifiers
- CAS
81-46-9- PubChem CID
- 66479
- DTXSID
DTXSID6058847- ChEMBL
CHEMBL1467123- ChEBI
CHEBI:116337- UNII
- QG4HKZ6WYA
- EC Number
- 201-351-4
- Nikkaji
- J82.081D
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 89.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 584
Physicochemical properties
- Melting point
- 228 · 228-230 °C
- Boiling point
- 478.64 °C · 478.64°C (rough estimate)
- Density
- 1.2754 · 1.2754 (rough estimate)
- refractive index
- 1.746 · 1.7460 (estimate)
- pka
- 12.14 · 12.14±0.20(Predicted)
- EWG's Food Scores
- 1 · 1
- FDA UNII
- 4 HKZ6WYA · QG4HKZ6WYA
- EPA Substance Registry System
- Benzamide, N-(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)- (81-46-9)
- TSCA
- TSCA listed
Safety & regulation
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzamide, N-(4-amino-9,10-dihydro-9,10-dioxo-1-anthracenyl)-: ACTIVE
Upstream & downstream products
Downstream products
Suppliers3 total
Alfa Chemistry+1-5166625404 · [email protected]
陕西缔都医药化工有限公司029-029-029-81148696 18161915376 · [email protected]
湖北玖天生物医药科技有限公司027-88013699 17354350817 · [email protected]
Additional notes
DefinitionChEBI: N-(4-amino-9,10-dioxo-1-anthracenyl)benzamide is an anthraquinone.
Related reactions
2 records
Compound notes
Loading…