Cas no 17434-50-3 ( )

  structure
  structure
Product Name: 
CAS No:17434-50-3
MF:C10H13N5O3
MW:251.241921186447
CID:906115
PubChem ID:269843
Update Time:2025-04-19

  Chemical and Physical Properties

Names and Identifiers

    • 6-(6-aminopurin-9-yl)oxane-3,4-diol
    • 9-(2-deoxypentopyranosyl)-9h-purin-6-amine
    • AC1L6NCF
    • AC1Q4X8I
    • AR-1H4962
    • CTK0I3599
    • NSC111359
    • NSC113941
    • 6-(6-amino-9H-purin-9-yl)oxane-3,4-diol
    • DTXSID30998244
    • 7697-49-6
    • DTXSID10296775
    • NSC-111359
    • NSC-113941
    • 6-(6-Amino-9H-purin-9-yl)tetrahydro-2H-pyran-3,4-diol
    • 17434-50-3
    •  
    • Inchi: 1S/C10H13N5O3/c11-9-8-10(13-3-12-9)15(4-14-8)7-1-5(16)6(17)2-18-7/h3-7,16-17H,1-2H2,(H2,11,12,13)
    • InChI Key: NCOXWUCHLQRZJI-UHFFFAOYSA-N
    • SMILES: O1CC(C(CC1N1C=NC2C(N)=NC=NC1=2)O)O

Computed Properties

  • Exact Mass: 251.10199
  • Monoisotopic Mass: 251.10183929g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 7
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 1
  • Complexity: 307
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 3
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.1
  • Topological Polar Surface Area: 119?2

Experimental Properties

  • PSA: 119.31
  • LogP: -0.36960
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