Cas no 438554-21-3 (PYRIMIDINE, 2-(1H-IMIDAZOL-2-YL)-, HYDROCHLORIDE)

PYRIMIDINE, 2-(1H-IMIDAZOL-2-YL)-, HYDROCHLORIDE structure
438554-21-3 structure
Product Name:PYRIMIDINE, 2-(1H-IMIDAZOL-2-YL)-, HYDROCHLORIDE
CAS No:438554-21-3
MF:C7H7ClN4
MW:182.610279321671
CID:3521036
PubChem ID:22260390
Update Time:2025-04-21

PYRIMIDINE, 2-(1H-IMIDAZOL-2-YL)-, HYDROCHLORIDE Chemical and Physical Properties

Names and Identifiers

    • PYRIMIDINE, 2-(1H-IMIDAZOL-2-YL)-, HYDROCHLORIDE
    • Pyrimidine, 2-(1H-imidazol-2-yl)-, hydrochloride (1:)
    • 438554-21-3
    • DKLMHMCWKOBRCX-UHFFFAOYSA-N
    • 2-(1H-imidazol-2-yl)pyrimidine hydrochloride
    • DB-147916
    • SCHEMBL3069705
    • 2-(1H-Imidazol-2-yl)-pyrimidine hydrochloride
    • Inchi: 1S/C7H6N4.ClH/c1-2-8-6(9-3-1)7-10-4-5-11-7;/h1-5H,(H,10,11);1H
    • InChI Key: DKLMHMCWKOBRCX-UHFFFAOYSA-N
    • SMILES: C1(C2=NC=CC=N2)=NC=CN1.Cl

Computed Properties

  • Exact Mass: 182.0359239Da
  • Monoisotopic Mass: 182.0359239Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 1
  • Complexity: 122
  • Covalently-Bonded Unit Count: 2
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 54.5?2
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