Cas no 24552-04-3 (3-Octanamine)

3-Octanamine structure
3-Octanamine structure
Product Name:3-Octanamine
CAS No:24552-04-3
MF:C8H19N
MW:129.24316239357
CID:2661001
PubChem ID:547362
Update Time:2025-04-21

3-Octanamine Chemical and Physical Properties

Names and Identifiers

    • octan-3-amine
    • 3-Octylamine
    • SCHEMBL120706
    • 3-Octanamine
    • 24552-04-3
    • oct-3-ylamine
    • Q5651966
    • Hexylamine, 1-ethyl-
    • 1-Ethylhexylamine #
    • 3-Aminooctane
    • DTXSID50338188
    • DTXCID80289275
    • Inchi: 1S/C8H19N/c1-3-5-6-7-8(9)4-2/h8H,3-7,9H2,1-2H3
    • InChI Key: JASMWYNKLTULAN-UHFFFAOYSA-N
    • SMILES: NC(CC)CCCCC

Computed Properties

  • Exact Mass: 129.151749610Da
  • Monoisotopic Mass: 129.151749610Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 1
  • Heavy Atom Count: 9
  • Rotatable Bond Count: 5
  • Complexity: 52.5
  • 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: 2.6
  • Topological Polar Surface Area: 26?2
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