Basic information
- CAS
88439-56-9- Standard SMILES
Nc1ccc2cc(S(=O)(=O)O)cc(O)c2c1N=Nc1ccccc1- InChIKey
AQNYJBKPOPUIHV-UHFFFAOYSA-N- Molecular formula
- C16H13N3O4S
- Average molar mass
- 343.4 g/mol
- Monoisotopic mass
- 343.06267708
Names & identifiers
- Preferred name
- 2-Naphthalenesulfonic acid, 6-amino-4-hydroxy-5-(phenylazo)-
- IUPAC
- 6-amino-4-hydroxy-5-phenyldiazenylnaphthalene-2-sulfonic acid
Names & synonyms
2-Naphthalenesulfonic acid, 6-amino-4-hydroxy-5-(phenylazo)-88439-56-9SCHEMBL7790539SCHEMBL7790541DTXSID704202566-Imino-4-oxo-5-(2-phenylhydrazin-1-yl)-4,6-dihydronaphthalene-2-sulfonic acid
Database identifiers
- CAS
88439-56-9- PubChem CID
- 413148
- DTXSID
DTXSID70420256
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 134 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 3
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 556
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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