2,6,8-Trichloro-9H-purine

CAS Registry Number®

2562-52-9
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CAS Name

2,6,8-Trichloro-9H-purine

Molecular Formula

C5HCl3N4

Molecular Mass

223.45

Cite this Page

2,6,8-Trichloro-9H-purine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2562-52-9 (retrieved 2024-09-08) (CAS RN: 2562-52-9).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    185 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C5HCl3N4/c6-2-1-3(11-4(7)9-1)12-5(8)10-2/h(H,9,10,11,12)

InChIKey

InChIKey=XPTCECRKQRKFLH-UHFFFAOYSA-N

SMILES

ClC1=C2C(N=C(Cl)N2)=NC(Cl)=N1

Canonical SMILES

ClC=1N=C(Cl)C=2NC(Cl)=NC2N1

Other Names for this Substance

  • 9H-Purine, 2,6,8-trichloro-
  • Purine, 2,6,8-trichloro-
  • 1H-Purine, 2,6,8-trichloro-
  • 2,6,8-Trichloro-9H-purine
  • 2,6,8-Trichloropurine

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Deleted or Replaced CAS Registry Numbers

611-83-6