Einecs 280-007-5
Basic information
- CAS
82640-07-1- Standard SMILES
COc1ccc(S(=O)(=O)[O-])cc1N.Nc1ccc([N+](=O)[O-])c(N)c1.[Cu].[Na+].[Na+].[O-]c1cccc(O)c1- InChIKey
HJDUSPQCBUUNBC-UHFFFAOYSA-L- Molecular formula
- C19H20CuN4Na2O8S
- Average molar mass
- 574 g/mol
- Monoisotopic mass
- 573.00932
Names & identifiers
- Preferred name
- Einecs 280-007-5
- IUPAC
- disodium;3-amino-4-methoxybenzenesulfonate;copper;3-hydroxyphenolate;4-nitrobenzene-1,3-diamine
Names & synonyms
EINECS 280-007-5
Database identifiers
- CAS
82640-07-1- PubChem CID
- 174283
Properties
Computed structural properties
- Topological polar surface area
- 242 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 11
- Rotatable bonds
- 1
- Heavy atoms
- 35
- Formal charge
- 0
- Complexity
- 474
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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