2-Chloro-8-(trifluoromethyl)-9H-purine

CAS Registry Number®

1060816-68-3

CAS Name

2-Chloro-8-(trifluoromethyl)-9H-purine

Molecular Formula

C6H2ClF3N4

Molecular Mass

222.56

Cite this Page

2-Chloro-8-(trifluoromethyl)-9H-purine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1060816-68-3 (retrieved 2025-01-04) (CAS RN: 1060816-68-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Other Names and Identifiers

InChI

InChI=1S/C6H2ClF3N4/c7-5-11-1-2-3(14-5)13-4(12-2)6(8,9)10/h1H,(H,11,12,13,14)

InChIKey

InChIKey=CSBSNTVZMCECQB-UHFFFAOYSA-N

SMILES

C(F)(F)(F)C=1NC=2C(N1)=NC(Cl)=NC2

Canonical SMILES

FC(F)(F)C1=NC=2N=C(Cl)N=CC2N1

Other Names for this Substance

  • 9H-Purine, 2-chloro-8-(trifluoromethyl)-
  • 2-Chloro-8-(trifluoromethyl)-9H-purine

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