1-(4-Chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl)ethanone

CAS Registry Number®

1363381-59-2
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CAS Name

1-(4-Chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl)ethanone

Molecular Formula

C8H6ClN3O

Molecular Mass

195.61

Cite this Page

1-(4-Chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl)ethanone.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1363381-59-2 (retrieved 2024-08-03) (CAS RN: 1363381-59-2).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C8H6ClN3O/c1-4(13)5-2-10-8-6(5)7(9)11-3-12-8/h2-3H,1H3,(H,10,11,12)

InChIKey

InChIKey=KXOFBMPFLUKIJL-UHFFFAOYSA-N

SMILES

C(C)(=O)C=1C=2C(NC1)=NC=NC2Cl

Canonical SMILES

O=C(C1=CNC=2N=CN=C(Cl)C21)C

Other Names for this Substance

  • Ethanone, 1-(4-chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl)-
  • 1-(4-Chloro-7H-pyrrolo[2,3-d]pyrimidin-5-yl)ethanone