1,2-Diazetidin-3-one, 4-methylbenzenesulfonate (1:1)

CAS Registry Number®

79289-49-9

CAS Name

1,2-Diazetidin-3-one, 4-methylbenzenesulfonate (1:1)

Molecular Formula

C7H8O3S.C2H4N2O

Cite this Page

1,2-Diazetidin-3-one, 4-methylbenzenesulfonate (1:1).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=79289-49-9 (retrieved 2024-11-26) (CAS RN: 79289-49-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    147-149 °C (decomp)

Source(s)

  • (1) Denotes property values from the ZIC/VINITI data file provided by InfoChem.

Other Names and Identifiers

InChI

InChI=1S/C7H8O3S.C2H4N2O/c1-6-2-4-7(5-3-6)11(8,9)10;5-2-1-3-4-2/h2-5H,1H3,(H,8,9,10);3H,1H2,(H,4,5)

InChIKey

InChIKey=SASDRDQNJSKFHJ-UHFFFAOYSA-N

SMILES

O=C1CNN1.S(=O)(=O)(O)C1=CC=C(C)C=C1

Canonical SMILES

O=C1NNC1.O=S(=O)(O)C1=CC=C(C=C1)C

Other Names for this Substance

  • 1,2-Diazetidin-3-one, 4-methylbenzenesulfonate (1:1)
  • 1,2-Diazetidin-3-one, mono(4-methylbenzenesulfonate)
  • 3-Oxo-1,2-diazetidinium tosylate

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