Cas no 93999-43-0 (N,N-diethyl-N'-[(2-ethyl-1-benzofuran-3-yl)methyl]propane-1,3-diamine)

N,N-diethyl-N'-[(2-ethyl-1-benzofuran-3-yl)methyl]propane-1,3-diamine structure
93999-43-0 structure
Product Name:N,N-diethyl-N'-[(2-ethyl-1-benzofuran-3-yl)methyl]propane-1,3-diamine
CAS No:93999-43-0
MF:C18H28N2O
MW:288.427724838257
CID:1982585
PubChem ID:3023237
Update Time:2025-04-21

N,N-diethyl-N'-[(2-ethyl-1-benzofuran-3-yl)methyl]propane-1,3-diamine Chemical and Physical Properties

Names and Identifiers

    • N,N-diethyl-N'-[(2-ethyl-1-benzofuran-3-yl)methyl]propane-1,3-diamine
    • N',N'-diethyl-N-[(2-ethyl-1-benzofuran-3-yl)methyl]propane-1,3-diamine
    • AKOS009027760
    • 3003 I.S.
    • N,N-Diethyl-N'-((2-ethyl-3-benzofuranyl)methyl)-1,3-propanediamine
    • 1,3-Propanediamine, N,N-diethyl-N'-((2-ethyl-3-benzofuranyl)methyl)-
    • BRN 1348025
    • DTXSID20240183
    • DTXCID20162674
    • 93999-43-0
    • Inchi: 1S/C18H28N2O/c1-4-17-16(15-10-7-8-11-18(15)21-17)14-19-12-9-13-20(5-2)6-3/h7-8,10-11,19H,4-6,9,12-14H2,1-3H3
    • InChI Key: OKPYFTIPNUYXIL-UHFFFAOYSA-N
    • SMILES: O1C2C=CC=CC=2C(=C1CC)CNCCCN(CC)CC

Computed Properties

  • Exact Mass: 288.220164
  • Monoisotopic Mass: 288.220164
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 21
  • Rotatable Bond Count: 9
  • Complexity: 280
  • 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: 28.4
  • XLogP3: 3.7

Experimental Properties

  • Density: 1.004
  • Boiling Point: 388°C at 760 mmHg
  • Flash Point: 188.4°C
  • Refractive Index: 1.543
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