1-(4-Isoquinolinyl)ethanone

CAS Registry Number®

40570-74-9
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CAS Name

1-(4-Isoquinolinyl)ethanone

Molecular Formula

C11H9NO

Molecular Mass

171.20

Cite this Page

1-(4-Isoquinolinyl)ethanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=40570-74-9 (retrieved 2024-05-01) (CAS RN: 40570-74-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Boiling Point (1)

    179 °C @ Press: 22 Torr

  • Melting Point (1)

    72-74 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C11H9NO/c1-8(13)11-7-12-6-9-4-2-3-5-10(9)11/h2-7H,1H3

InChIKey

InChIKey=XLJRDBSCZSXFNM-UHFFFAOYSA-N

SMILES

C(C)(=O)C=1C2=C(C=NC1)C=CC=C2

Canonical SMILES

O=C(C1=CN=CC2=CC=CC=C21)C

Other Names for this Substance

  • Ethanone, 1-(4-isoquinolinyl)-
  • Ketone, 4-isoquinolyl methyl
  • 1-(4-Isoquinolinyl)ethanone
  • 4-Acetylisoquinoline
  • 1-(Isoquinolin-4-yl)ethan-1-one

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