5-Aza-2′-deoxycytidine

CAS Registry Number®

2353-33-5
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CAS Name

5-Aza-2′-deoxycytidine

Molecular Formula

C8H12N4O4

Molecular Mass

228.21

Cite this Page

5-Aza-2′-deoxycytidine.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=2353-33-5 (retrieved 2024-04-20) (CAS RN: 2353-33-5).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    198-199 °C (decomp)

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C8H12N4O4/c9-7-10-3-12(8(15)11-7)6-1-4(14)5(2-13)16-6/h3-6,13-14H,1-2H2,(H2,9,11,15)/t4-,5+,6+/m0/s1

InChIKey

InChIKey=XAUDJQYHKZQPEU-KVQBGUIXSA-N

SMILES

O=C1N([C@@H]2O[C@H](CO)[C@@H](O)C2)C=NC(N)=N1

Canonical SMILES

O=C1N=C(N=CN1C2OC(CO)C(O)C2)N

Other Names for this Substance

  • 1,3,5-Triazin-2(1H)-one, 4-amino-1-(2-deoxy-β-D-erythro-pentofuranosyl)-
  • s-Triazin-2(1H)-one, 4-amino-1-(2-deoxy-β-D-erythro-pentofuranosyl)-
  • 4-Amino-1-(2-deoxy-β-D-erythro-pentofuranosyl)-1,3,5-triazin-2(1H)-one
  • 5-Aza-2′-deoxycytidine
  • 5-Azadeoxycytidine

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Deleted or Replaced CAS Registry Numbers

105597-46-4, 123795-43-7

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