Cas no 42928-87-0 (4-(Prop-2-enoyloxy)octane)

4-(Prop-2-enoyloxy)octane structure
4-(Prop-2-enoyloxy)octane structure
Product Name:4-(Prop-2-enoyloxy)octane
CAS No:42928-87-0
MF:C11H20O2
MW:184.275303840637
CID:1006660
PubChem ID:543889
Update Time:2025-04-20

4-(Prop-2-enoyloxy)octane Chemical and Physical Properties

Names and Identifiers

    • 4-(Prop-2-enoyloxy)octane
    • DTXSID10880890
    • SCHEMBL2129127
    • IJRVDOPVQJSPRP-UHFFFAOYSA-N
    • NS00096252
    • 1-Propylpentyl acrylate #
    • 42928-87-0
    • Inchi: 1S/C11H20O2/c1-4-7-9-10(8-5-2)13-11(12)6-3/h6,10H,3-5,7-9H2,1-2H3
    • InChI Key: IJRVDOPVQJSPRP-UHFFFAOYSA-N
    • SMILES: O(C(C=C)=O)C(CCC)CCCC

Computed Properties

  • Exact Mass: 184.146329876g/mol
  • Monoisotopic Mass: 184.146329876g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 13
  • Rotatable Bond Count: 8
  • Complexity: 152
  • 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: 3.8
  • Topological Polar Surface Area: 26.3?2
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