1-Amino-5-(2,4-dibromoanilino)-4,8-dihydroxyanthracene-9,10-dione
Basic information
- CAS
51889-17-9- Standard SMILES
Nc1ccc(O)c2c1C(=O)c1c(O)ccc(Nc3ccc(Br)cc3Br)c1C2=O- InChIKey
ROMDDSWHQOFEBB-UHFFFAOYSA-N- Molecular formula
- C20H12Br2N2O4
- Average molar mass
- 504.1 g/mol
- Monoisotopic mass
- 501.91638
Names & identifiers
- Preferred name
- 1-Amino-5-(2,4-dibromoanilino)-4,8-dihydroxyanthracene-9,10-dione
- IUPAC
- 1-amino-5-(2,4-dibromoanilino)-4,8-dihydroxyanthracene-9,10-dione
- English name
- 1-amino-5-[(2,4-dibromophenyl)amino]-4,8-dihydroxyanthraquinone
- Molecular formula
- C20H12Br2N2O4
- Molecular weight
- 504.13
Names & synonyms
51889-17-9EINECS 257-497-48F6P5ZD6GL1-Amino-5-(2,4-dibromoanilino)-4,8-dihydroxyanthraquinone1-amino-5-(2,4-dibromoanilino)-4,8-dihydroxyanthracene-9,10-dione9,10-Anthracenedione, 1-amino-5-[(2,4-dibromophenyl)amino]-4,8-dihydroxy-DTXSID70686819,10-Anthracenedione, 1-amino-5-((2,4-dibromophenyl)amino)-4,8-dihydroxy-1-Amino-5-((2,4-dibromophenyl)amino)-4,8-dihydroxyanthraquinone1-AMINO-5-[(2,4-DIBROMOPHENYL)AMINO]-4,8-DIHYDROXYANTHRAQUINONE1-Amino-5-[(2,4-dibromophenyl)amino]-4,8-dihydroxy-9,10-anthracenedione1-AMINO-5-((2,4-DIBROMOPHENYL)AMINO)-4,8-DIHYDROXY-9,10-ANTHRACENEDIONE
Show more names
RefChem:429362DTXCID7041093257-497-4UNII-8F6P5ZD6GLSCHEMBL31037857ROMDDSWHQOFEBB-UHFFFAOYSA-NDB-291339NS00032367
Database identifiers
- CAS
51889-17-9- PubChem CID
- 104002
- DTXSID
DTXSID7068681- UNII
- 8F6P5ZD6GL
- EC Number
- 257-497-4
- Nikkaji
- J294.940G
Properties
Computed structural properties
- XLogP
- 5.5
- Topological polar surface area
- 113 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 635
Physicochemical properties
- FDA UNII
- 8 F6P5ZD6GL · 8F6P5ZD6GL
- EPA Substance Registry System
- 9 · 9,10-Anthracenedione, 1-amino-5-[(2,4-dibromophenyl)amino]-4,8-dihydroxy- (51889-17-9)
- 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-5-[(2,4-dibromophenyl)amino]-4,8-dihydroxy-: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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