7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-chloro-, ethyl ester

CAS Registry Number®

144927-57-1

CAS Name

7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-chloro-, ethyl ester

Molecular Formula

C9H8ClN3O2

Molecular Mass

225.63

Cite this Page

7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-chloro-, ethyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=144927-57-1 (retrieved 2024-11-25) (CAS RN: 144927-57-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    140-141 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C9H8ClN3O2/c1-2-15-9(14)5-3-11-8-6(5)7(10)12-4-13-8/h3-4H,2H2,1H3,(H,11,12,13)

InChIKey

InChIKey=PCLIRPRTLSCXET-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 7H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-chloro-, ethyl ester
  • 1H-Pyrrolo[2,3-d]pyrimidine-5-carboxylic acid, 4-chloro-, ethyl ester
  • Ethyl 4-chloro-7H-pyrrolo[2,3-d]pyrimidine-5-carboxylate

CAS INSIGHTSTM
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