Cas no 16465-34-2 (9H-Purin-6-amine,N-(3-methyl-3-buten-1-yl)-)

9H-Purin-6-amine,N-(3-methyl-3-buten-1-yl)- structure
16465-34-2 structure
Product Name:9H-Purin-6-amine,N-(3-methyl-3-buten-1-yl)-
CAS No:16465-34-2
MF:C10H13N5
MW:203.243720769882
CID:230404
PubChem ID:3364183
Update Time:2025-04-19

9H-Purin-6-amine,N-(3-methyl-3-buten-1-yl)- Chemical and Physical Properties

Names and Identifiers

    • 9H-Purin-6-amine,N-(3-methyl-3-buten-1-yl)-
    • N-(3-methylbut-3-enyl)-7H-purin-6-amine
    • AC1MO6DT
    • LS40030
    • N6-isopentenyladenine
    • N-isopentenyleadenine
    • NSC121924
    • SureCN101602
    • 16465-34-2
    • NSC-121924
    • SCHEMBL16112317
    • DTXSID80391827
    • SCHEMBL101602
    • Inchi: 1S/C10H13N5/c1-7(2)3-4-11-9-8-10(13-5-12-8)15-6-14-9/h5-6H,1,3-4H2,2H3,(H2,11,12,13,14,15)
    • InChI Key: BPRQFDNBWVMLPS-UHFFFAOYSA-N
    • SMILES: N(C1=C2C(=NC=N1)N=CN2)CCC(=C)C

Computed Properties

  • Exact Mass: 203.11729
  • Monoisotopic Mass: 203.11709544g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 4
  • Complexity: 230
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 2.3
  • Topological Polar Surface Area: 66.5?2

Experimental Properties

  • PSA: 61.47
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