Isoguanine

CAS Registry Number®

3373-53-3
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CAS Name

Isoguanine

Molecular Formula

C5H5N5O

Molecular Mass

151.13

Cite this Page

Isoguanine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/ChemicalDetail.aspx?ref=3373-53-3 (retrieved 2024-04-25) (CAS RN: 3373-53-3).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    >360 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C5H5N5O/c6-3-2-4(8-1-7-2)10-5(11)9-3/h1H,(H4,6,7,8,9,10,11)

InChIKey

InChIKey=DRAVOWXCEBXPTN-UHFFFAOYSA-N

SMILES

NC=1C2=C(NC(=O)N1)N=CN2

Canonical SMILES

O=C1N=C(N)C=2NC=NC2N1

Other Names for this Substance

  • 2H-Purin-2-one, 6-amino-3,7-dihydro-
  • Isoguanine
  • 2H-Purin-2-one, 6-amino-1,3-dihydro-
  • 6-Amino-3,7-dihydro-2H-purin-2-one
  • 2-Oxyadenine

Deleted or Replaced CAS Registry Numbers

492-32-0, 2684-07-3, 26788-75-0

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