4-[(4-Aminophenyl)diazenyl]benzenesulfonate
Basic information
- CAS
54111-80-7- Standard SMILES
Nc1ccc(N=Nc2ccc(S(=O)(=O)[O-])cc2)cc1- InChIKey
PPVRMPPLECDING-UHFFFAOYSA-M- Molecular formula
- C12H10N3O3S-
- Average molar mass
- 276.29 g/mol
- Monoisotopic mass
- 276.04428736
Names & identifiers
- Preferred name
- 4-[(4-Aminophenyl)diazenyl]benzenesulfonate
- IUPAC
- 4-[(4-aminophenyl)diazenyl]benzenesulfonate
Names & synonyms
4-[(4-aminophenyl)diazenyl]benzenesulfonateDTXSID9085918054111-80-74-[(4-Aminophenyl)diazenyl]benzene-1-sulfonate
Database identifiers
- CAS
54111-80-7- PubChem CID
- 5169738
- DTXSID
DTXSID90859180- Nikkaji
- J3.647.395I
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 116 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- -1
- Complexity
- 389
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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