Ammonium 5-amino-2-nitrobenzenesulphonate
Basic information
- CAS
71411-69-3- Standard SMILES
N.Nc1ccc([N+](=O)[O-])c(S(=O)(=O)O)c1- InChIKey
PYYHPWAJORDQFM-UHFFFAOYSA-N- Molecular formula
- C6H9N3O5S
- Average molar mass
- 235.22 g/mol
- Monoisotopic mass
- 235.02629157
Names & identifiers
- Preferred name
- Ammonium 5-amino-2-nitrobenzenesulphonate
- IUPAC
- 5-amino-2-nitrobenzenesulfonic acid;azane
Names & synonyms
71411-69-3Ammonium 5-amino-2-nitrobenzenesulphonateDTXSID40991746PYYHPWAJORDQFM-UHFFFAOYSA-NEINECS 275-373-85-Amino-2-nitrobenzene-1-sulfonic acid--ammonia (1/1)
Database identifiers
- CAS
71411-69-3- PubChem CID
- 117142
- DTXSID
DTXSID40991746- EC Number
- 275-373-8
Properties
Computed structural properties
- Topological polar surface area
- 136 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 1
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 316
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Related reactions
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Compound notes
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