Basic information
- CAS
5258-48-0- Standard SMILES
Cc1ccc(S(=O)(=O)[O-])c2ccccc12.[Na+]- InChIKey
QBYLJSRWWOKLAM-UHFFFAOYSA-M- Molecular formula
- C11H9NaO3S
- Average molar mass
- 244.24 g/mol
- Monoisotopic mass
- 244.0170096
Names & identifiers
- Preferred name
- Sodium 4-methyl-1-naphthalenesulfonate
- IUPAC
- sodium 4-methylnaphthalene-1-sulfonate
Names & synonyms
Sodium 4-methyl-1-naphthalenesulfonate0T389YYK1USodium 1-methylnaphthalene-4-sulfonateUNII-0T389YYK1U1-Naphthalenesulfonic acid, 4-methyl-, sodium salt (1:1)5258-48-0SCHEMBL11192937SCHEMBL30274447Q27237221
Database identifiers
- CAS
5258-48-0- PubChem CID
- 22945019
- UNII
- 0T389YYK1U
- Nikkaji
- J178.666K
Properties
Computed structural properties
- Topological polar surface area
- 65.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 323
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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