Cas no 31295-52-0 (1-[2-[(2-aminoethyl)[2-[(2-aminoethyl)amino]ethyl] amino]ethyl]-Piperazine)

1-[2-[(2-aminoethyl)[2-[(2-aminoethyl)amino]ethyl] amino]ethyl]-Piperazine structure
31295-52-0 structure
Product Name:1-[2-[(2-aminoethyl)[2-[(2-aminoethyl)amino]ethyl] amino]ethyl]-Piperazine
CAS No:31295-52-0
MF:C12H30N6
MW:258.406801700592
CID:916463
PubChem ID:53422286
Update Time:2025-04-19

1-[2-[(2-aminoethyl)[2-[(2-aminoethyl)amino]ethyl] amino]ethyl]-Piperazine Chemical and Physical Properties

Names and Identifiers

    • 1-[2-[(2-aminoethyl)[2-[(2-aminoethyl)amino]ethyl] amino]ethyl]-Piperazine
    • N'-[2-[2-aminoethyl(2-piperazin-1-ylethyl)amino]ethyl]ethane-1,2-diamine
    • DTXSID40698041
    • SITOZYZUCZQNGO-UHFFFAOYSA-N
    • SCHEMBL15657166
    • 31295-52-0
    • N~1~,N~2~-Bis(2-aminoethyl)-N~1~-[2-(piperazin-1-yl)ethyl]ethane-1,2-diamine
    • Inchi: 1S/C12H30N6/c13-1-3-15-4-8-17(7-2-14)11-12-18-9-5-16-6-10-18/h15-16H,1-14H2
    • InChI Key: SITOZYZUCZQNGO-UHFFFAOYSA-N
    • SMILES: N1(CCNCC1)CCN(CCN)CCNCCN

Computed Properties

  • Exact Mass: 258.253
  • Monoisotopic Mass: 258.253
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 10
  • Complexity: 183
  • 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: 82.6A^2
  • XLogP3: -2.7
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