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Benzenesulfonic acid, 4,4'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis-, sodium salt (1:2)

HCID 81269
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Basic information

CAS
6826-44-4
Standard SMILES
O=c1[nH]c(-c2ccc(S(=O)(=O)[O-])cc2)c(-c2ccc(S(=O)(=O)[O-])cc2)[nH]1.[Na+].[Na+]
InChIKey
APSHMRVPXPERJJ-UHFFFAOYSA-L
Molecular formula
C15H10N2Na2O7S2
Average molar mass
440.4 g/mol
Monoisotopic mass
439.97248157

Names & identifiers

Preferred name
Benzenesulfonic acid, 4,4'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis-, sodium salt (1:2)
IUPAC
disodium;4-[2-oxo-5-(4-sulfonatophenyl)-1,3-dihydroimidazol-4-yl]benzenesulfonate
English name
disodium p,p'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis(benzenesulphonate)
Molecular formula
C15H13N2NaO7S2
Molecular weight
420.39

Names & synonyms

6826-44-4Benzenesulfonic acid, 4,4'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis-, sodium salt (1:2)EINECS 229-901-9DTXSID40889573Benzenesulfonic acid, 4,4'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis-, disodium saltRefChem:117919DTXCID301028826disodium;4-[2-oxo-5-(4-sulfonatophenyl)-1,3-dihydroimidazol-4-yl]benzenesulfonate5255-91-4disodium 4,4'-(2-oxo-2,3-dihydro-1H-imidazole-4,5-diyl)dibenzenesulfonateDisodium p,p'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis(benzenesulphonate)Cambridge id 5255914
Show more names
C.I.40640Blancol TWUltraphor WTC.I.Fluorescent Brightener 484,5-Bis(4-sodiosulfophenyl)-1H-imidazol-2(3H)-one4,4'-(2-oxo-2,3-dihydro-1H-imidazole-4,5-diyl)-bis-benzenesulfonic acid4,4'-(2-Oxo-2,3-dihydro-1H-imidazole-4,5-diyl)bis(benzenesulfonic acid sodium) salt
SCHEMBL22653282Disodium 4,4'-(2-oxo-2,3-dihydro-1H-imidazole-4,5-diyl)di(benzene-1-sulfonate)

Database identifiers

CAS
6826-44-4
PubChem CID
81269
DTXSID
DTXSID40889573
EC Number
229-901-9

Properties

Computed structural propertiesFilling in

Topological polar surface area
172 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
7
Rotatable bonds
2
Heavy atoms
28
Formal charge
0
Complexity
699

Physicochemical properties

EPA Substance Registry System
4 · Benzenesulfonic acid, 4,4'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis-, disodium salt (6826-44-4)
TSCA
TSCA listed

Safety & regulation

Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.

Safety data

tsca
TSCA listed

Chemistry & industry

Uses & manufacturing

General Manufacturing InformationBenzenesulfonic acid, 4,4'-(2,3-dihydro-2-oxo-1H-imidazole-4,5-diyl)bis-, sodium salt (1:2): INACTIVE

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