Cas no 111451-25-3 (2,6-Pyridinediamine,3,5-diethoxy-)

2,6-Pyridinediamine,3,5-diethoxy- structure
111451-25-3 structure
Product Name:2,6-Pyridinediamine,3,5-diethoxy-
CAS No:111451-25-3
MF:C9H15N3O2
MW:197.234301805496
CID:129263
PubChem ID:20157139
Update Time:2025-04-18

2,6-Pyridinediamine,3,5-diethoxy- Chemical and Physical Properties

Names and Identifiers

    • 2,6-Pyridinediamine,3,5-diethoxy-
    • 2,6-Diamino-3,5-diethoxypyridine
    • 2,6-Pyridinediamine,3,5-diethoxy-(9CI)
    • 3,5-Diethoxypyridine-2,6-diamine
    • SCHEMBL10774903
    • 111451-25-3
    • Inchi: 1S/C9H15N3O2/c1-3-13-6-5-7(14-4-2)9(11)12-8(6)10/h5H,3-4H2,1-2H3,(H4,10,11,12)
    • InChI Key: FJQZHCLZZMCBCQ-UHFFFAOYSA-N
    • SMILES: O(CC)C1C(N)=NC(=C(C=1)OCC)N

Computed Properties

  • Exact Mass: 197.11655
  • Monoisotopic Mass: 197.116
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 4
  • Complexity: 152
  • 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
  • Topological Polar Surface Area: 83.4A^2
  • XLogP3: 0.8

Experimental Properties

  • PSA: 83.39
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