Anthrimide
Basic information
- CAS
82-22-4- Standard SMILES
O=C1c2ccccc2C(=O)c2c(Nc3cccc4c3C(=O)c3ccccc3C4=O)cccc21- InChIKey
WITKIIIPSSFHST-UHFFFAOYSA-N- Molecular formula
- C28H15NO4
- Average molar mass
- 429.4 g/mol
- Monoisotopic mass
- 429.10010796
Names & identifiers
- Preferred name
- Anthrimide
- IUPAC
- 1-[(9,10-dioxoanthracen-1-yl)amino]anthracene-9,10-dione
- English name
- 1,1'-DIANTHRIMIDE
- Molecular formula
- C28H15NO4
- Molecular weight
- 429.42
Names & synonyms
Anthrimide1,1'-Dianthrimide1,1'-IminodianthraquinoneDianthrimide1,1'-Dianthraquinonylamine1,1-Dianthrimid9,10-Anthracenedione, 1,1'-iminobis-Imino-1,1'-bianthraquinoneDi-1,1'-anthrachinonylamin1,1-Dianthrimid [Czech]Bis-(1-anthrachinonyl)aminNSC 7226
Show more names
DIANTHRAQUINONYLAMINE1,1'-DIANTHRIMIDE, 97+%DI(1-ANTHRAQUINOYL)AMINE1,1’-iminodi-anthraquinondi-1,1’-anthrachinonylamin
Bis-(1-anthrachinonyl)amin [Czech]ANTHRAQUINONE, 1,1'-IMINODI-Bis(1-anthraquinonyl)amineEINECS 201-405-7UNII-717ZXC72EADi-1,1'-anthrachinonylamin [Czech]BRN 2607016717ZXC72EA
Database identifiers
- CAS
82-22-4- PubChem CID
- 6700
- DTXSID
DTXSID4058865- UNII
- 717ZXC72EA
- EC Number
- 201-405-7
- Nikkaji
- J4.609D
Properties
Computed structural properties
- XLogP
- 5.9
- Topological polar surface area
- 80.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 33
- Formal charge
- 0
- Complexity
- 783
Experimental & physicochemical properties
Chemical ClassesDyes -> Anthraquinone Dyes
Physical DescriptionDeep red or lustrous coppery red solid; [Merck Index] Dark red powder; [Aldrich MSDS]
Physicochemical properties
- Melting point
- 300 °C · 300 °C
- Boiling point
- 544.01 °C · 544.01°C (rough estimate)
- Density
- 1.295 · 1.2950 (rough estimate)
- refractive index
- 1.629 · 1.6290 (estimate)
- pka
- -4.72 · -4.72±0.20(Predicted)
- form
- powder to crystal
- color
- Orange to Brown to Dark red
- Merck
- 14 · 14,690
- CAS DataBase Reference
- 82 · 82-22-4(CAS DataBase Reference)
- FDA UNII
- 717 ZXC72EA · 717ZXC72EA
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1,1'-iminobis- (82-22-4)
- Symbol(GHS)
- 7 · GHS07
- Signal word
- Warning
- Hazard statements
- 320 · H320
- Precautionary statements
- 264 · P264-P305+P351+P338+P337+P313
- Hazard Codes
- Xi
- Risk Statements
- 36 · 36/37/38
- Safety Statements
- 37 · 37/39-26
- WGK Germany
- 3 · 3
- RTECS
- 7780000 · CB7780000
- TSCA
- TSCA listed
- HS Code
- 2922.39 · 2922.39.4500
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
H319 (100%): Causes serious eye irritation [Warning Serious eye damage/eye irritation]
P264+P265, P280, P305+P351+P338, and P337+P317 (click each P-code to see the statement)
Aggregated GHS information provided per 39 reports by companies from 2 notifications to the ECHA C&L Inventory.
Hazard information
Regulatory InformationChemical: 9,10-Anthracenedione, 1,1'-iminobis-
Hazards SummaryA mild skin and eye irritant; [RTECS] May cause irritation; [Aldrich MSDS]
Hazard Classes and CategoriesEye Irrit. 2 (100%)
Safety data
- wgk
- 3
- tsca
- TSCA listed
- rtecs
- CB7780000
- hs_code
- 2922.39.4500
- risk_code
- 36/37/38
- Signal word
- Warning
- Symbol(GHS)
- GHS07
- hazard_code
- Xi
- safety_code
- 37/39-26
- Hazard statements
- H320
- Precautionary statements
- P264-P305+P351+P338+P337+P313
Chemistry & industry
Uses & manufacturing
UsesUsed for the determination of boron and silicon; [Merck Index]
General Manufacturing Information9,10-Anthracenedione, 1,1'-iminobis-: ACTIVE
Applications
UsesDetermination of boron. 1,1'-Dianthrimide is used as a 0.02% solution in Concentrated H2SO4. The olive-green solution turns blue in the presence of boron. The blue solution has an absorption max at 620 nm. Also used in the determination of silicon.
Upstream & downstream products
Downstream products
Related reactions
7 records
Compound notes
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