Cas no 143411-84-1 (2-Piperazinecarboxaldehyde,3,6-dioxo-)

2-Piperazinecarboxaldehyde,3,6-dioxo- structure
143411-84-1 structure
Product Name:2-Piperazinecarboxaldehyde,3,6-dioxo-
CAS No:143411-84-1
MF:C5H6N2O3
MW:142.1127409935
CID:108330
PubChem ID:15646789
Update Time:2025-04-18

2-Piperazinecarboxaldehyde,3,6-dioxo- Chemical and Physical Properties

Names and Identifiers

    • 2-Piperazinecarboxaldehyde,3,6-dioxo-
    • CS-0046479
    • 3,6-Dioxopiperazine-2-carbaldehyde
    • SCHEMBL9186967
    • 2-Piperazinecarboxaldehyde, 3,6-dioxo- (9CI)
    • 143411-84-1
    • Inchi: 1S/C5H6N2O3/c8-2-3-5(10)6-1-4(9)7-3/h2-3H,1H2,(H,6,10)(H,7,9)
    • InChI Key: DWSCUWDVACJAAE-UHFFFAOYSA-N
    • SMILES: O=C1C(C=O)NC(CN1)=O

Computed Properties

  • Exact Mass: 142.03788
  • Monoisotopic Mass: 142.03784206g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 1
  • Complexity: 189
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.6
  • Topological Polar Surface Area: 75.3?2

Experimental Properties

  • PSA: 75.27
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