Basic information
- CAS
2944-19-6- Standard SMILES
Cc1ccc(Nc2cccc3c2C(=O)c2ccccc2C3=O)cc1- InChIKey
LMJVMVCQHQVJDB-UHFFFAOYSA-N- Molecular formula
- C21H15NO2
- Average molar mass
- 313.3 g/mol
- Monoisotopic mass
- 313.11027872
Names & identifiers
- Preferred name
- 1-(p-Toluidino)anthraquinone
- IUPAC
- 1-(4-methylanilino)anthracene-9,10-dione
- English name
- 1-[(4-methylphenyl)amino]anthraquinone
- Molecular formula
- C21H15NO2
- Molecular weight
- 313.3493
Names & synonyms
2FF7ZYK46U1-(p-toluidino)anthraquinone9,10-Anthracenedione, 1-[(4-methylphenyl)amino]-1-((4-Methylphenyl)amino)anthraquinone9,10-Anthracenedione, 1-((4-methylphenyl)amino)-DTXSID30627301-[(4-METHYLPHENYL)AMINO]ANTHRAQUINONE1-[(4-Methylphenyl)amino]-9,10-anthracenedione1-((4-METHYLPHENYL)AMINO)-9,10-ANTHRACENEDIONERefChem:196986DTXCID00379922944-19-6
Show more names
1-p-Tolylamino-anthraquinone
1-(p-Tolylamino)anthracene-9,10-dioneEINECS 220-944-91-(4-methylanilino)anthracene-9,10-dioneUNII-2FF7ZYK46USCHEMBL1275834SCHEMBL300819561-(4-methylanilino)anthraquinoneLMJVMVCQHQVJDB-UHFFFAOYSA-N
Database identifiers
- CAS
2944-19-6- PubChem CID
- 76264
- DTXSID
DTXSID3062730- UNII
- 2FF7ZYK46U
- EC Number
- 220-944-9
- Nikkaji
- J306.871D
Properties
Computed structural properties
- XLogP
- 5.8
- Topological polar surface area
- 46.2 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 2
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 494
Physicochemical properties
- FDA UNII
- 2 FF7ZYK46U · 2FF7ZYK46U
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1-[(4-methylphenyl)amino]- (2944-19-6)
- 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-[(4-methylphenyl)amino]-: INACTIVE
Suppliers4 total
HANGZHOU LEAP CHEM CO., LTD.+86-571-87711850 +86-15355479329 · [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]
江苏艾康生物医药研发有限公司025-58859352 18651614124 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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