9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)-
Basic information
- CAS
14449-97-9- Standard SMILES
Nc1ccc(Nc2ccc([N+](=O)[O-])cc2[N+](=O)[O-])c2c1C(=O)c1ccccc1C2=O- InChIKey
WYDBWQFSXBDNFU-UHFFFAOYSA-N- Molecular formula
- C20H12N4O6
- Average molar mass
- 404.3 g/mol
- Monoisotopic mass
- 404.07568412
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)-
- IUPAC
- 1-amino-4-(2,4-dinitroanilino)anthracene-9,10-dione
- English name
- 1-amino-4-(2,4-dinitroanilino)anthraquinone
- Molecular formula
- C20H12N4O6
- Molecular weight
- 404.33
Names & synonyms
9,10-Anthracenedione, 1-amino-4-[(2,4-dinitrophenyl)amino]-EINECS 238-429-2DTXSID6065769Anthraquinone, 1-amino-4-(2,4-dinitroanilino)-9,10-Anthracenedione, 1-amino-4-((2,4-dinitrophenyl)amino)-RefChem:548669DTXCID003469914449-97-91-amino-4-(2,4-dinitroanilino)anthracene-9,10-dione1-Amino-4-(2,4-dinitroanilino)anthraquinoneWYDBWQFSXBDNFU-UHFFFAOYSA-NNS00024698
Show more names
1-Amino-4-(2,4-dinitroanilino)-9,10-anthraquinone
Database identifiers
- CAS
14449-97-9- PubChem CID
- 5483699
- DTXSID
DTXSID6065769- EC Number
- 238-429-2
- Nikkaji
- J217.019A
Properties
Computed structural properties
- XLogP
- 4.5
- Topological polar surface area
- 164 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 2
- Heavy atoms
- 30
- Formal charge
- 0
- Complexity
- 734
Physicochemical properties
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1-amino-4-[(2,4-dinitrophenyl)amino]- (14449-97-9)
- 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-amino-4-[(2,4-dinitrophenyl)amino]-: INACTIVE
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Related reactions
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Compound notes
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