Cas no 72063-77-5 (4-Pyrimidinamine, 2,6-dichloro-N-propyl-)

4-Pyrimidinamine, 2,6-dichloro-N-propyl- structure
72063-77-5 structure
Product Name:4-Pyrimidinamine, 2,6-dichloro-N-propyl-
CAS No:72063-77-5
MF:C7H9Cl2N3
MW:206.072458982468
CID:544621
PubChem ID:15338432
Update Time:2025-04-19

4-Pyrimidinamine, 2,6-dichloro-N-propyl- Chemical and Physical Properties

Names and Identifiers

    • 4-Pyrimidinamine, 2,6-dichloro-N-propyl-
    • 2,6-DICHLORO-N-PROPYL-4-PYRIMIDINAMINE
    • 2,6-dichloro-N-propylpyrimidin-4-amine
    • 72063-77-5
    • DTXSID90571714
    • IANUGQINIJIROT-UHFFFAOYSA-N
    • SCHEMBL15719830
    • (2,6-dichloro-pyrimidin-4-yl)-n-propylamine
    • 2,6-Dichloro-4-n-propylaminopyrimidine
    • Inchi: 1S/C7H9Cl2N3/c1-2-3-10-6-4-5(8)11-7(9)12-6/h4H,2-3H2,1H3,(H,10,11,12)
    • InChI Key: IANUGQINIJIROT-UHFFFAOYSA-N
    • SMILES: ClC1=CC(=NC(=N1)Cl)NCCC

Computed Properties

  • Exact Mass: 205.01757
  • Monoisotopic Mass: 205.0173527g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 3
  • Complexity: 134
  • 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: 3.3
  • Topological Polar Surface Area: 37.8?2

Experimental Properties

  • PSA: 37.81
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