Basic information
- CAS
68444-12-2- Standard SMILES
O=[N+]([O-])c1cccc(C(O)S(=O)(=O)[O-])c1.[Na+]- InChIKey
CWHBAYODKMITBS-UHFFFAOYSA-M- Molecular formula
- C7H6NNaO6S
- Average molar mass
- 255.18 g/mol
- Monoisotopic mass
- 254.98135237
Names & identifiers
- Preferred name
- Benzenemethanesulfonic acid, alpha-hydroxy-3-nitro-, sodium salt (1:1)
- IUPAC
- sodium hydroxy-(3-nitrophenyl)methanesulfonate
Names & synonyms
68444-12-2m-Nitrobenzaldehyde bisulfite, monosodium saltEINECS 270-584-1DTXSID30887265Benzenemethanesulfonic acid, alpha-hydroxy-3-nitro-, monosodium saltBenzenemethanesulfonic acid, alpha-hydroxy-3-nitro-, sodium salt (1:1)Benzenemethanesulfonic acid, .alpha.-hydroxy-3-nitro-, sodium salt (1:1)RefChem:117664DTXCID801026570Sodium alpha-hydroxy-m-nitrotoluene-alpha-sulphonateBenzenemethanesulfonic acid, a-hydroxy-3-nitro-, monosodium saltBenzenemethanesulfonic acid, .alpha.-hydroxy-3-nitro-, monosodium salt
Show more names
NS00062797sodium;hydroxy-(3-nitrophenyl)methanesulfonateSODIUM HYDROXY(3-NITROPHENYL)METHANESULFONATE
Database identifiers
- CAS
68444-12-2- PubChem CID
- 110320
- DTXSID
DTXSID30887265- EC Number
- 270-584-1
Properties
Computed structural properties
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 1
- Heavy atoms
- 16
- Formal charge
- 0
- Complexity
- 315
Chemistry & industry
Uses & manufacturing
General Manufacturing InformationBenzenemethanesulfonic acid, .alpha.-hydroxy-3-nitro-, sodium salt (1:1): INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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