2-Chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid

CAS Registry Number®

1211443-58-1
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CAS Name

2-Chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid

Molecular Formula

C12H12ClN3O2

Molecular Mass

265.70

Cite this Page

2-Chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1211443-58-1 (retrieved 2024-09-07) (CAS RN: 1211443-58-1).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    223-225 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H12ClN3O2/c13-12-14-6-7-5-9(11(17)18)16(10(7)15-12)8-3-1-2-4-8/h5-6,8H,1-4H2,(H,17,18)

InChIKey

InChIKey=LXCZVGKSFJMLRO-UHFFFAOYSA-N

SMILES

C(O)(=O)C=1N(C=2C(C1)=CN=C(Cl)N2)C3CCCC3

Canonical SMILES

O=C(O)C1=CC=2C=NC(Cl)=NC2N1C3CCCC3

Other Names for this Substance

  • 7H-Pyrrolo[2,3-d]pyrimidine-6-carboxylic acid, 2-chloro-7-cyclopentyl-
  • 2-Chloro-7-cyclopentyl-7H-pyrrolo[2,3-d]pyrimidine-6-carboxylic acid