QTX

CAS Registry Number®

103430-24-6

CAS Name

QTX

Molecular Formula

C21H26NO3S.Cl

Cite this Page

QTX.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=103430-24-6 (retrieved 2024-11-24) (CAS RN: 103430-24-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    269-271 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C21H26NO3S.ClH/c1-13-14(2)21-17(20(24)16-8-6-7-9-19(16)26-21)10-18(13)25-12-15(23)11-22(3,4)5;/h6-10,15,23H,11-12H2,1-5H3;1H/q+1;/p-1

InChIKey

InChIKey=KLQWZWNTTNRVOZ-UHFFFAOYSA-M

SMILES

O=C1C=2C(SC=3C1=CC=CC3)=C(C)C(C)=C(OCC(C[N+](C)(C)C)O)C2.[Cl-]

Canonical SMILES

[Cl-].O=C1C=2C=CC=CC2SC=3C1=CC(OCC(O)C[N+](C)(C)C)=C(C3C)C

Other Names for this Substance

  • 1-Propanaminium, 3-[(3,4-dimethyl-9-oxo-9H-thioxanthen-2-yl)oxy]-2-hydroxy-N,N,N-trimethyl-, chloride (1:1)
  • 1-Propanaminium, 3-[(3,4-dimethyl-9-oxo-9H-thioxanthen-2-yl)oxy]-2-hydroxy-N,N,N-trimethyl-, chloride
  • 9H-Thioxanthene, 1-propanaminium deriv.
  • WB 4759
  • Quantacure QTX

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