Quinocetone

CAS Registry Number®

81810-66-4
No image available.

CAS Name

Quinocetone

Molecular Formula

C18H14N2O3

Molecular Mass

306.32

Cite this Page

Quinocetone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=81810-66-4 (retrieved 2024-09-19) (CAS RN: 81810-66-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    187-188 °C

Source(s)

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

Other Names and Identifiers

InChI

InChI=1S/C18H14N2O3/c1-13-18(17(21)12-11-14-7-3-2-4-8-14)20(23)16-10-6-5-9-15(16)19(13)22/h2-12H,1H3

InChIKey

InChIKey=IOKWXGMNRWVQHX-UHFFFAOYSA-N

SMILES

O=N=1C2=C(N(=O)=C(C)C1C(C=CC3=CC=CC=C3)=O)C=CC=C2

Canonical SMILES

O=C(C=CC=1C=CC=CC1)C2=C(N(=O)=C3C=CC=CC3=N2=O)C

Other Names for this Substance

  • 2-Propen-1-one, 1-(3-methyl-1,4-dioxido-2-quinoxalinyl)-3-phenyl-
  • 2-Propen-1-one, 1-(3-methyl-2-quinoxalinyl)-3-phenyl-, N,N′-dioxide
  • 1-(3-Methyl-1,4-dioxido-2-quinoxalinyl)-3-phenyl-2-propen-1-one
  • NSC 621477
  • Quinocetone

Deleted or Replaced CAS Registry Numbers

871487-59-1, 850339-82-1