3H-Diazirine-3-ethanol, 3-methyl-, 3-(4-methylbenzenesulfonate)

CAS Registry Number®

25055-84-9
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CAS Name

3H-Diazirine-3-ethanol, 3-methyl-, 3-(4-methylbenzenesulfonate)

Molecular Formula

C11H14N2O3S

Molecular Mass

254.31

Cite this Page

3H-Diazirine-3-ethanol, 3-methyl-, 3-(4-methylbenzenesulfonate).   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=25055-84-9 (retrieved 2024-09-06) (CAS RN: 25055-84-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H14N2O3S/c1-9-3-5-10(6-4-9)17(14,15)16-8-7-11(2)12-13-11/h3-6H,7-8H2,1-2H3

InChIKey

InChIKey=MZQMGXQUJVZNBT-UHFFFAOYSA-N

SMILES

S(OCCC1(C)N=N1)(=O)(=O)C2=CC=C(C)C=C2

Canonical SMILES

O=S(=O)(OCCC1(N=N1)C)C2=CC=C(C=C2)C

Other Names for this Substance

  • 3H-Diazirine-3-ethanol, 3-methyl-, 3-(4-methylbenzenesulfonate)
  • 3H-Diazirine-3-ethanol, 3-methyl-, p-toluenesulfonate (ester)
  • 3H-Diazirine-3-ethanol, 3-methyl-, 4-methylbenzenesulfonate (ester)
  • 2-(3-Methyl-3H-diazirin-3-yl)ethyl 4-methylbenzene-1-sulfonate