Basic information
- CAS
3008-76-2- Standard SMILES
CN(C)c1ccc(Nc2cccc3c2C(=O)c2cccc(Nc4ccc(N(C)C)cc4)c2C3=O)cc1- InChIKey
MPORBOAYQHWUMK-UHFFFAOYSA-N- Molecular formula
- C30H28N4O2
- Average molar mass
- 476.6 g/mol
- Monoisotopic mass
- 476.22122615
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1,5-bis((4-(dimethylamino)phenyl)amino)-
- IUPAC
- 1,5-bis[4-(dimethylamino)anilino]anthracene-9,10-dione
- English name
- 1,5-bis[[4-(dimethylamino)phenyl]amino]anthraquinone
- Molecular formula
- C30H28N4O2
- Molecular weight
- 476.57
Names & synonyms
9,10-Anthracenedione, 1,5-bis[[4-(dimethylamino)phenyl]amino]-EINECS 221-124-3DTXSID40627791,5-Di-(4'-dimethylaminoanilino)anthraquinone9,10-Anthracenedione, 1,5-bis((4-(dimethylamino)phenyl)amino)-RefChem:548567DTXCID40381323008-76-21,5-Bis((4-(dimethylamino)phenyl)amino)anthraquinone1,5-bis[4-(dimethylamino)anilino]anthracene-9,10-dione1,5-BIS[[4-(DIMETHYLAMINO)PHENYL]AMINO]ANTHRAQUINONESCHEMBL9307323
Show more names
1,5-Bis[[4-(dimethylamino)phenyl]amino]-9,10-anthracenedione
MPORBOAYQHWUMK-UHFFFAOYSA-NNS00028844
Database identifiers
- CAS
3008-76-2- PubChem CID
- 76367
- DTXSID
DTXSID4062779- EC Number
- 221-124-3
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 64.7 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 6
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 705
Physicochemical properties
- Boiling point
- 685.9 · 685.9±55.0 °C(Predicted)
- Density
- 1.298 · 1.298±0.06 g/cm3(Predicted)
- pka
- 6.73 · 6.73±0.24(Predicted)
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1,5-bis[[4-(dimethylamino)phenyl]amino]- (3008-76-2)
- TSCA
- TSCA listed
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Safety data
- tsca
- TSCA listed
Chemistry & industry
Uses & manufacturing
General Manufacturing Information9,10-Anthracenedione, 1,5-bis[[4-(dimethylamino)phenyl]amino]-: INACTIVE
Suppliers4 total
重庆福腾医药有限公司18696571988 · [email protected]
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]
DAYANG CHEM (HANGZHOU) CO.,LTD+86-88938639 +86-17705817739 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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