Benzamide, N,N'-(9,10-dihydro-9,10-dioxo-1,8-anthracenediyl)bis-
Basic information
- CAS
10114-51-9- Standard SMILES
O=C(Nc1cccc2c1C(=O)c1c(NC(=O)c3ccccc3)cccc1C2=O)c1ccccc1- InChIKey
MHIIKMFLEZGYPH-UHFFFAOYSA-N- Molecular formula
- C28H18N2O4
- Average molar mass
- 446.5 g/mol
- Monoisotopic mass
- 446.12665706
Names & identifiers
- Preferred name
- Benzamide, N,N'-(9,10-dihydro-9,10-dioxo-1,8-anthracenediyl)bis-
- IUPAC
- N-(8-benzamido-9,10-dioxoanthracen-1-yl)benzamide
- English name
- 1,8-Bis(benzamido)anthraquinone
- Molecular formula
- C28H18N2O4
- Molecular weight
- 446.45352
Names & synonyms
10114-51-91,8-bis(benzamido)anthraquinoneDTXSID60385603Benzamide, N,N'-(9,10-dihydro-9,10-dioxo-1,8-anthracenediyl)bis-RefChem:561504DTXCID70336626660-206-7N,N'-(9,10-Dioxo-9,10-dihydroanthracene-1,8-diyl)dibenzamideN-(8-benzamido-9,10-dioxoanthracen-1-yl)benzamideCBMicro_016368SCHEMBL10705711CCG-5458
Show more names
AKOS003614416BIM-0016453.P001
Database identifiers
- CAS
10114-51-9- PubChem CID
- 2839734
- DTXSID
DTXSID60385603- EC Number
- 660-206-7
Properties
Computed structural properties
- XLogP
- 5.1
- 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
- 736
Physicochemical properties
- Hazard statements
- 413 · H413
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
H413 (100%): May cause long lasting harmful effects to aquatic life [Hazardous to the aquatic environment, long-term hazard]
P273, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 1 notifications to the ECHA C&L Inventory.
Hazard information
Hazard Classes and CategoriesAquatic Chronic 4 (100%)
Safety data
- Hazard statements
- H413
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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