6-Fluoro-9-(phenylmethyl)-9H-purine

CAS Registry Number®

1545-97-7
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CAS Name

6-Fluoro-9-(phenylmethyl)-9H-purine

Molecular Formula

C12H9FN4

Molecular Mass

228.23

Cite this Page

6-Fluoro-9-(phenylmethyl)-9H-purine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1545-97-7 (retrieved 2024-06-23) (CAS RN: 1545-97-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    127-131 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C12H9FN4/c13-11-10-12(15-7-14-11)17(8-16-10)6-9-4-2-1-3-5-9/h1-5,7-8H,6H2

InChIKey

InChIKey=OPTPECWDHXUJNC-UHFFFAOYSA-N

SMILES

C(N1C=2C(N=C1)=C(F)N=CN2)C3=CC=CC=C3

Canonical SMILES

FC1=NC=NC2=C1N=CN2CC=3C=CC=CC3

Other Names for this Substance

  • 9H-Purine, 6-fluoro-9-(phenylmethyl)-
  • 9H-Purine, 9-benzyl-6-fluoro-
  • 6-Fluoro-9-(phenylmethyl)-9H-purine

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