N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bisacetamide
Basic information
- CAS
6534-28-7- Standard SMILES
CC(=O)Nc1ccc(NC(C)=O)c2c1C(=O)c1ccccc1C2=O- InChIKey
KPHHXNVVLVNAMV-UHFFFAOYSA-N- Molecular formula
- C18H14N2O4
- Average molar mass
- 322.3 g/mol
- Monoisotopic mass
- 322.09535693
Names & identifiers
- Preferred name
- N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bisacetamide
- IUPAC
- N-(4-acetamido-9,10-dioxoanthracen-1-yl)acetamide
- English name
- 1,4-Diacetamidoanthraquinone
- Molecular formula
- C18H14N2O4
- Molecular weight
- 322.31
Names & synonyms
N,N'-(9,10-Dihydro-9,10-dioxo-1,4-anthracenediyl)bisacetamideRefChem:8216501,4-Diacetamidoanthraquinone6534-28-71,4-Diacetylaminoanthraquinone1,4-Diacetamido-9,10-anthracenedioneN,N'-(9,10-Dioxo-9,10-dihydroanthracene-1,4-diyl)diacetamideN-(4-acetamido-9,10-dioxoanthracen-1-yl)acetamideAnthraquinone, 1,4-diacetamido-Acetamide, N,N'-(9,10-dihydro-9,10-dioxo-1,4-anthrylene)bis-ACETAMIDE, N,N'-(9,10-DIHYDRO-9,10-DIOXO-1,4-ANTHRACENEDIYL)BIS-NSC-60604
Show more names
N,N'-(9,10-Anthraquinone-1,4-diyl)bis(acetamide)n,n’-(9,10-dihydro-9,10-dioxo-1,4-anthrylene)bis-acetamidn,n’-(9,10-dihydro-9,10-dioxo-1,4-anthracenediyl)bis-acetamidN-(4-acetamido-9,10-dioxo-9,10-dihydroanthracene-1-yl)acetamide
427328JO96EINECS 229-435-6NSC 60604BRN 0931332Acetamide, N,N'-1,4-anthraquinonylenebis-UNII-427328JO96SCHEMBL6370986DTXSID20215674
Database identifiers
- CAS
6534-28-7- PubChem CID
- 23032
- DTXSID
DTXSID20215674- UNII
- 427328JO96
- EC Number
- 229-435-6
- Nikkaji
- J62.264H
Properties
Computed structural properties
- XLogP
- 2.3
- Topological polar surface area
- 92.3 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 523
Physicochemical properties
- FDA UNII
- 427328 JO96 · 427328JO96
- Symbol(GHS)
- 9 · GHS09
- Signal word
- Warning
- Hazard statements
- 400 · H400
- Precautionary statements
- 273 · P273-P391-P501
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
GHS classification
GHS Classification
Warning
H400 (100%): Very toxic to aquatic life [Warning Hazardous to the aquatic environment, acute hazard]
P273, P391, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 38 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Acute 1 (100%)
Safety data
- Signal word
- Warning
- Symbol(GHS)
- GHS09
- Hazard statements
- H400
- Precautionary statements
- P273-P391-P501
Chemistry & industry
Upstream & downstream products
Downstream products
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…