Cas no 6404-60-0 (Benzenesulfonic acid, 2,2'-(1,2-ethanediyl)bis[5-nitro-)

Benzenesulfonic acid, 2,2'-(1,2-ethanediyl)bis[5-nitro- structure
6404-60-0 structure
Product Name:Benzenesulfonic acid, 2,2'-(1,2-ethanediyl)bis[5-nitro-
CAS No:6404-60-0
MF:C14H12N2O10S2
MW:432.382481575012
CID:425067
Update Time:2024-01-29

Benzenesulfonic acid, 2,2'-(1,2-ethanediyl)bis[5-nitro- Chemical and Physical Properties

Names and Identifiers

    • Benzenesulfonic acid, 2,2'-(1,2-ethanediyl)bis[5-nitro-
    • Inchi: 1S/C14H12N2O10S2/c17-15(18)11-5-3-9(13(7-11)27(21,22)23)1-2-10-4-6-12(16(19)20)8-14(10)28(24,25)26/h3-8H,1-2H2,(H,21,22,23)(H,24,25,26)
    • InChI Key: HIWGPUSFNWIYHO-UHFFFAOYSA-N
    • SMILES: C(C1=CC=C([N+]([O-])=O)C=C1S(O)(=O)=O)CC1=CC=C([N+]([O-])=O)C=C1S(O)(=O)=O

Computed Properties

  • Exact Mass: 431.99336

Experimental Properties

  • Density: 1.714±0.06 g/cm3(Predicted)
  • PSA: 195.02
  • pka: -1.51±0.36(Predicted)

Benzenesulfonic acid, 2,2'-(1,2-ethanediyl)bis[5-nitro- Production Method

Production Method 1

Reaction Conditions
1.1 Reagents: Hydrogen Catalysts: Calcium carbonate ,  Palladium Solvents: Ethanol ;  0.5 - 5 MPa, 303 - 373 K
Reference
Selective hydrogenation of unsaturated nitro compounds in the presence of Pd catalysts
Masenova, A. T., Izvestiya Natsional'noi Akademii Nauk Respubliki Kazakhstan, 2003, (5), 13-17

Benzenesulfonic acid, 2,2'-(1,2-ethanediyl)bis[5-nitro- Raw materials

Benzenesulfonic acid, 2,2'-(1,2-ethanediyl)bis[5-nitro- Preparation Products

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