Cas no 61444-90-4 (Acetamide, 2-(hydroxyimino)-N-[3-(phenylamino)propyl]-)

Acetamide, 2-(hydroxyimino)-N-[3-(phenylamino)propyl]- structure
61444-90-4 structure
Product Name:Acetamide, 2-(hydroxyimino)-N-[3-(phenylamino)propyl]-
CAS No:61444-90-4
MF:C11H15N3O2
MW:221.255702257156
CID:479163
PubChem ID:71395832
Update Time:2025-04-19

Acetamide, 2-(hydroxyimino)-N-[3-(phenylamino)propyl]- Chemical and Physical Properties

Names and Identifiers

    • Acetamide, 2-(hydroxyimino)-N-[3-(phenylamino)propyl]-
    • N-(3-anilinopropyl)-2-hydroxyiminoacetamide
    • N-(3-Anilinopropyl)-2-(hydroxyimino)acetamide
    • 61444-90-4
    • DTXSID60817434
    • Inchi: 1S/C11H15N3O2/c15-11(9-14-16)13-8-4-7-12-10-5-2-1-3-6-10/h1-3,5-6,9,12,16H,4,7-8H2,(H,13,15)
    • InChI Key: SZGRJVHGJRUKND-UHFFFAOYSA-N
    • SMILES: O=C(C=NO)NCCCNC1C=CC=CC=1

Computed Properties

  • Exact Mass: 221.11655
  • Monoisotopic Mass: 221.116426730g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 3
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 6
  • Complexity: 225
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 1
  • XLogP3: 2.8
  • Topological Polar Surface Area: 73.7?2

Experimental Properties

  • PSA: 73.72
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