4-[2-(4-Methylphenyl)diazenyl]benzenesulfonic acid
Basic information
- CAS
26516-44-9- Standard SMILES
Cc1ccc(N=Nc2ccc(S(=O)(=O)O)cc2)cc1- InChIKey
AUWWQKWWOILLIZ-UHFFFAOYSA-N- Molecular formula
- C13H12N2O3S
- Average molar mass
- 276.31 g/mol
- Monoisotopic mass
- 276.05686342
Names & identifiers
- Preferred name
- 4-[2-(4-Methylphenyl)diazenyl]benzenesulfonic acid
- IUPAC
- 4-[(4-methylphenyl)diazenyl]benzenesulfonic acid
Names & synonyms
4-[2-(4-Methylphenyl)diazenyl]benzenesulfonic acid26516-44-9SCHEMBL9612273SCHEMBL13861833DTXSID5012295354-[(4-Methylphenyl)diazenyl]benzene-1-sulfonic acid
Database identifiers
- CAS
26516-44-9- PubChem CID
- 44222
- DTXSID
DTXSID501229535
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 87.5 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 400
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Compound notes
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