Bretylium tosylate

CAS Registry Number®

61-75-6

CAS Name

Bretylium tosylate

Molecular Formula

C11H17BrN.C7H7O3S

Cite this Page

Bretylium tosylate.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=61-75-6 (retrieved 2024-11-22) (CAS RN: 61-75-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    97-99 °C

Source(s)

  • (1) Drugs - Synonyms and Properties data were obtained from Ashgate Publishing Co. (US)

Other Names and Identifiers

InChI

InChI=1S/C11H17BrN.C7H8O3S/c1-4-13(2,3)9-10-7-5-6-8-11(10)12;1-6-2-4-7(5-3-6)11(8,9)10/h5-8H,4,9H2,1-3H3;2-5H,1H3,(H,8,9,10)/q+1;/p-1

InChIKey

InChIKey=KVWNWTZZBKCOPM-UHFFFAOYSA-M

SMILES

S(=O)(=O)([O-])C1=CC=C(C)C=C1.C([N+](CC)(C)C)C1=C(Br)C=CC=C1

Canonical SMILES

O=S(=O)([O-])C1=CC=C(C=C1)C.BrC=1C=CC=CC1C[N+](C)(C)CC

Other Names for this Substance

  • Benzenemethanaminium, 2-bromo-N-ethyl-N,N-dimethyl-, 4-methylbenzenesulfonate (1:1)
  • (o-Bromobenzyl)ethyldimethylammonium p-toluenesulfonate
  • Ammonium, (o-bromobenzyl)ethyldimethyl-, p-toluenesulfonate
  • Benzenemethanaminium, 2-bromo-N-ethyl-N,N-dimethyl-, salt with 4-methylbenzenesulfonic acid (1:1)
  • Bretylium tosylate

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CAS INSIGHTSTM
Targeted protein degrader structure, illustration