Basic information
- CAS
24069-55-4- Standard SMILES
Nc1ccc(O)c2c1C(=O)c1c([N+](=O)[O-])ccc(O)c1C2=O- InChIKey
XHTBQEDDFNUDSX-UHFFFAOYSA-N- Molecular formula
- C14H8N2O6
- Average molar mass
- 300.22 g/mol
- Monoisotopic mass
- 300.03823598
Names & identifiers
- Preferred name
- 9,10-Anthracenedione, 1-amino-4,5-dihydroxy-8-nitro-
- IUPAC
- 1-amino-4,5-dihydroxy-8-nitroanthracene-9,10-dione
- English name
- 1-amino-4,5-dihydroxy-8-nitroanthraquinone
- Molecular formula
- C14H8N2O6
- Molecular weight
- 300.22
Names & synonyms
9,10-Anthracenedione, 1-amino-4,5-dihydroxy-8-nitro-RefChem:54866224069-55-41-Amino-4,5-dihydroxy-8-nitroanthraquinone1-amino-4,5-dihydroxy-8-nitroanthracene-9,10-dioneEINECS 246-004-867C7V88VDFSCHEMBL10400291DTXSID301788021-amino-8-nitro-4,5-dihydroxyanthraquinoneNS000275511-Amino-4,5-dihydroxy-8-nitro-9,10-anthracenedione
Show more names
4-Amino-1,8-dihydroxy-5-nitroanthraquinone
Database identifiers
- CAS
24069-55-4- PubChem CID
- 5484079
- DTXSID
DTXSID30178802- UNII
- 67C7V88VDF
- EC Number
- 246-004-8
- Nikkaji
- J29.715A
Properties
Computed structural properties
- XLogP
- 2.4
- Topological polar surface area
- 146 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 0
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 518
Physicochemical properties
- FDA UNII
- 67 C7V88VDF · 67C7V88VDF
Safety & regulation
Hazard information
Regulatory InformationChemical: 9,10-Anthracenedione, 1-amino-4,5-dihydroxy-8-nitro-
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Related reactions
8 records
Compound notes
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