Benzenesulfonic acid, 4-[(3-formyl-4-hydroxyphenyl)azo]-
Basic information
- CAS
16358-43-3- Standard SMILES
O=Cc1cc(N=Nc2ccc(S(=O)(=O)O)cc2)ccc1O- InChIKey
KFEGCNCQBAEWMI-UHFFFAOYSA-N- Molecular formula
- C13H10N2O5S
- Average molar mass
- 306.3 g/mol
- Monoisotopic mass
- 306.0310426
Names & identifiers
- Preferred name
- Benzenesulfonic acid, 4-[(3-formyl-4-hydroxyphenyl)azo]-
- IUPAC
- 4-[(3-formyl-4-hydroxyphenyl)diazenyl]benzenesulfonic acid
Names & synonyms
16358-43-3CHEMBL1741142SCHEMBL10726374Benzenesulfonic acid, 4-[(3-formyl-4-hydroxyphenyl)azo]-DTXSID804254594-[2-(3-Formyl-4-oxocyclohexa-2,5-dien-1-ylidene)hydrazin-1-yl]benzene-1-sulfonic acid
Database identifiers
- CAS
16358-43-3- PubChem CID
- 417984
- DTXSID
DTXSID80425459- ChEMBL
CHEMBL1741142- Nikkaji
- J1.989.927F
Properties
Computed structural properties
- XLogP
- 2.1
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 4
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 479
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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