Cas no 63616-15-9 (1-methylheptyl methacrylate)

1-methylheptyl methacrylate structure
1-methylheptyl methacrylate structure
Product Name:1-methylheptyl methacrylate
CAS No:63616-15-9
MF:C12H22O2
MW:198.301884174347
CID:960560
PubChem ID:3017445
Update Time:2025-04-19

1-methylheptyl methacrylate Chemical and Physical Properties

Names and Identifiers

    • 1-methylheptyl methacrylate
    • octan-2-yl 2-methylprop-2-enoate
    • 1-methylheptyl 2-methylprop-2-enoate
    • SCHEMBL300866
    • KUZUWYWVINGZKL-UHFFFAOYSA-N
    • EINECS 264-369-1
    • 63616-15-9
    • DTXSID40979827
    • NS00055533
    • DB-312241
    • 2-octyl methacrylate
    • Inchi: 1S/C12H22O2/c1-5-6-7-8-9-11(4)14-12(13)10(2)3/h11H,2,5-9H2,1,3-4H3
    • InChI Key: KUZUWYWVINGZKL-UHFFFAOYSA-N
    • SMILES: O(C(C(=C)C)=O)C(C)CCCCCC

Computed Properties

  • Exact Mass: 198.16206
  • Monoisotopic Mass: 198.161979940g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 8
  • Complexity: 185
  • 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: 4.8
  • Topological Polar Surface Area: 26.3?2

Experimental Properties

  • PSA: 26.3
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