Cas no 112318-10-2 (3-Cyclopentene-1,2-diol,5-(4-amino-1H-imidazo[4,5-c]pyridin-1-yl)-, (1R,2S,5S)-rel-)

3-Cyclopentene-1,2-diol,5-(4-amino-1H-imidazo[4,5-c]pyridin-1-yl)-, (1R,2S,5S)-rel- structure
112318-10-2 structure
Product Name:3-Cyclopentene-1,2-diol,5-(4-amino-1H-imidazo[4,5-c]pyridin-1-yl)-, (1R,2S,5S)-rel-
CAS No:112318-10-2
MF:C11H12N4O2
MW:232.23858165741
CID:197848
PubChem ID:490352
Update Time:2025-04-19

3-Cyclopentene-1,2-diol,5-(4-amino-1H-imidazo[4,5-c]pyridin-1-yl)-, (1R,2S,5S)-rel- Chemical and Physical Properties

Names and Identifiers

    • 3-Cyclopentene-1,2-diol,5-(4-amino-1H-imidazo[4,5-c]pyridin-1-yl)-, (1R,2S,5S)-rel-
    • 9-(2',3'-dihydroxycyclopent-4'-enyl)-3-deazaadenine
    • (1S,2R,5R)-5-(4-amino-1H-imidazo[4,5-c]pyridin-1-yl)cyclopent-3-ene-1,2-diol
    • 3-Cyclopentene-1,2-diol, 5-(4-amino-1H-imidazo(4,5-c)pyridin-1-yl)-, (1alpha,2alpha,5beta)-
    • 5'-Dhcda
    • 5'-Nordeazaneplanocina
    • 9-(trans-2',trans-3'-Dihydroxycyclopent-4'-enyl)-3-deazaadenine
    • Ttdhda
    • 112318-10-2
    • SCHEMBL1935353
    • AVS-6282
    • A802591
    • UJJIREDPTVPNLW-MRTMQBJTSA-N
    • C^3DHCeA
    • 5-(4-Imino-4,5-dihydro-1H-imidazo[4,5-c]pyridin-1-yl)cyclopent-3-ene-1,2-diol
    • (1S,2R,5R)-5-(4-aminoimidazo[4,5-c]pyridin-1-yl)cyclopent-3-ene-1,2-diol
    • (1S,2R,5R)-5-(4-azanylimidazo[4,5-c]pyridin-1-yl)cyclopent-3-ene-1,2-diol
    • (1S,2R,5R)-5-(4-amino-1-imidazo[4,5-c]pyridinyl)cyclopent-3-ene-1,2-diol
    • 9-[Trans-2'-trans-3'-dihydroxycyclopent-4'-enyl]-3-deazaadenine
    • DTXSID80920732
    • Inchi: 1S/C11H12N4O2/c12-11-9-6(3-4-13-11)15(5-14-9)7-1-2-8(16)10(7)17/h1-5,7-8,10,16-17H,(H2,12,13)/t7-,8-,10+/m1/s1
    • InChI Key: UJJIREDPTVPNLW-MRTMQBJTSA-N
    • SMILES: O[C@@H]1[C@@H](C=C[C@H]1N1C=NC2C(N)=NC=CC1=2)O

Computed Properties

  • Exact Mass: 232.096
  • Monoisotopic Mass: 232.096
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 17
  • Rotatable Bond Count: 1
  • Complexity: 325
  • 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: -0.9
  • Topological Polar Surface Area: 97.2?2

Experimental Properties

  • Density: 1.71
  • Boiling Point: 548.9°Cat760mmHg
  • Flash Point: 285.8°C
  • Refractive Index: 1.823
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