Cas no 121086-97-3 (2(1H)-Pyrimidinone,1-(3-azido-2,3-dideoxy-b-D-erythro-pentofuranosyl)-5-methyl-)

2(1H)-Pyrimidinone,1-(3-azido-2,3-dideoxy-b-D-erythro-pentofuranosyl)-5-methyl- structure
121086-97-3 structure
Product Name:2(1H)-Pyrimidinone,1-(3-azido-2,3-dideoxy-b-D-erythro-pentofuranosyl)-5-methyl-
CAS No:121086-97-3
MF:C10H13N5O3
MW:251.241921186447
CID:162480
PubChem ID:451579
Update Time:2025-04-19

2(1H)-Pyrimidinone,1-(3-azido-2,3-dideoxy-b-D-erythro-pentofuranosyl)-5-methyl- Chemical and Physical Properties

Names and Identifiers

    • 2(1H)-Pyrimidinone,1-(3-azido-2,3-dideoxy-b-D-erythro-pentofuranosyl)-5-methyl-
    • 1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)oxolan-2-yl]-5-methylpyrimidin-2-one
    • 1-(3-Azido-2,3-dideoxy-.beta.-D-erythropentofuranosyl)-5-methyl-2(1H)-pyrimidinone
    • 1-(3-Azido-2,3-dideoxy-beta-D-erythropentofuranosyl)-5-methyl-2(1H)-pyrimidinone
    • 2(1H)-Pyrimidinone, 1-(3-azido-2,3-dideoxy-beta-D-erythro-pentofuranosyl)-5-methyl-
    • 1-(3-Azido-2,3-dideoxy-beta-D-erythro-pentofuranosyl)-5-methyl-2(1H)-pyrimidinone
    • 1-(3-Azido-2,3-dideoxy-beta-D-erythro-pentofuranosyl)-5-methyl-2-(1H)-pyrimidinone
    • CRDRWKSYEXVRGH-DJLDLDEBSA-N
    • 2(1H)-Pyrimidinone, 1-(3-azido-2,3-dideoxy-b-D-erythro-pentofuranosyl)-5-methyl-
    • 4-HAZT
    • 121086-97-3
    • 1-[(2R,4S,5S)-4-azido-5-(hydroxymethyl)tetrahydrofuran-2-yl]-5-methyl-pyrimidin-2-one
    • DTXSID60153147
    • Inchi: 1S/C10H13N5O3/c1-6-3-12-10(17)15(4-6)9-2-7(13-14-11)8(5-16)18-9/h3-4,7-9,16H,2,5H2,1H3/t7-,8+,9+/m0/s1
    • InChI Key: CRDRWKSYEXVRGH-DJLDLDEBSA-N
    • SMILES: O1[C@H](C[C@@H]([C@H]1CO)N=[N+]=[N-])N1C(N=CC(C)=C1)=O

Computed Properties

  • Exact Mass: 251.10199
  • Monoisotopic Mass: 251.102
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 3
  • Complexity: 454
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 3
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 0.3
  • Topological Polar Surface Area: 76.5?2

Experimental Properties

  • Boiling Point: °Cat760mmHg
  • Flash Point: °C
  • PSA: 110.89
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