Basic information
- CAS
21982-51-4- Standard SMILES
O=C1c2cccc(Nc3ccccc3[N+](=O)[O-])c2C(=O)c2cccc(Nc3ccccc3[N+](=O)[O-])c21- InChIKey
WOXKBZOCKBHPDR-UHFFFAOYSA-N- Molecular formula
- C26H16N4O6
- Average molar mass
- 480.4 g/mol
- Monoisotopic mass
- 480.10698424
Names & identifiers
- Preferred name
- 1,5-Bis(o-nitroanilino)anthraquinone
- IUPAC
- 1,5-bis(2-nitroanilino)anthracene-9,10-dione
- English name
- 1,5-bis(o-nitroanilino)anthraquinone
- Molecular formula
- C26H16N4O6
- Molecular weight
- 480.42844
Names & synonyms
1,5-Bis(o-nitroanilino)anthraquinone21982-51-4EINECS 244-694-51,5-bis(2-nitroanilino)anthracene-9,10-dioneDTXSID20944573WOXKBZOCKBHPDR-UHFFFAOYSA-NNS000508841,5-Bis(o-nitroanilino)-9,10-anthraquinone
Database identifiers
- CAS
21982-51-4- PubChem CID
- 89126
- DTXSID
DTXSID20944573- EC Number
- 244-694-5
- Nikkaji
- J225.499I
Properties
Computed structural properties
- XLogP
- 6.7
- Topological polar surface area
- 150 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 4
- Heavy atoms
- 36
- Formal charge
- 0
- Complexity
- 801
Chemistry & industry
Suppliers1 total
陕西缔都新材料有限公司029-63373950 17392216152 · [email protected]
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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