9H-Purin-6-amine, 1-oxide

CAS Registry Number®

700-02-7
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CAS Name

9H-Purin-6-amine, 1-oxide

Molecular Formula

C5H5N5O

Molecular Mass

151.13

Cite this Page

9H-Purin-6-amine, 1-oxide.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=700-02-7 (retrieved 2024-04-25) (CAS RN: 700-02-7).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    177 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C5H5N5O/c6-4-3-5(8-1-7-3)9-2-10(4)11/h1-2H,6H2,(H,7,8,9)

InChIKey

InChIKey=TXTRWVWGYHUIAI-UHFFFAOYSA-N

SMILES

NC1=C2C(=NC=N1=O)N=CN2

Canonical SMILES

O=N=1C=NC=2N=CNC2C1N

Other Names for this Substance

  • 9H-Purin-6-amine, 1-oxide
  • Adenine, 1-oxide
  • 3H-Purin-6-amine, 1-oxide
  • Adenine N1-oxide
  • NSC 110037

Deleted or Replaced CAS Registry Numbers

935-84-2

CAS INSIGHTSTM
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