2-Chloro-6-(1-pyrrolidinyl)-9H-purine-9-acetic acid

CAS Registry Number®

1374407-87-0
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CAS Name

2-Chloro-6-(1-pyrrolidinyl)-9H-purine-9-acetic acid

Molecular Formula

C11H12ClN5O2

Molecular Mass

281.70

Cite this Page

2-Chloro-6-(1-pyrrolidinyl)-9H-purine-9-acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1374407-87-0 (retrieved 2024-08-16) (CAS RN: 1374407-87-0).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C11H12ClN5O2/c12-11-14-9(16-3-1-2-4-16)8-10(15-11)17(6-13-8)5-7(18)19/h6H,1-5H2,(H,18,19)

InChIKey

InChIKey=ZYUHQVZSIPHOFE-UHFFFAOYSA-N

SMILES

C(C(O)=O)N1C=2C(=C(N=C(Cl)N2)N3CCCC3)N=C1

Canonical SMILES

O=C(O)CN1C=NC=2C1=NC(Cl)=NC2N3CCCC3

Other Names for this Substance

  • 9H-Purine-9-acetic acid, 2-chloro-6-(1-pyrrolidinyl)-
  • 2-Chloro-6-(1-pyrrolidinyl)-9H-purine-9-acetic acid