Cas no 82807-35-0 (Dibutylmaleat-)

Dibutylmaleat- structure
Dibutylmaleat- structure
Product Name:Dibutylmaleat-
CAS No:82807-35-0
MF:C12H20O4
MW:228.284804344177
CID:988200
PubChem ID:7774
Update Time:2025-04-20

Dibutylmaleat- Chemical and Physical Properties

Names and Identifiers

    • AKOS025243605
    • FT-0625165
    • 2_butenedioic acid dibutyl ester
    • DTXSID50859186
    • 2-butenedioic acid dibutylester
    • JBSLOWBPDRZSMB-UHFFFAOYSA-N
    • dibutylmaleat-
    • 82807-35-0
    • FT-0625164
    • DB-040654
    • DB-040653
    • Dibutylmaleat-
    • Inchi: 1S/C12H20O4/c1-3-5-9-15-11(13)7-8-12(14)16-10-6-4-2/h7-8H,3-6,9-10H2,1-2H3
    • InChI Key: JBSLOWBPDRZSMB-UHFFFAOYSA-N
    • SMILES: O(C(C=CC(=O)OCCCC)=O)CCCC

Computed Properties

  • Exact Mass: 228.13615911g/mol
  • Monoisotopic Mass: 228.13615911g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 10
  • Complexity: 209
  • 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: 2.7
  • Topological Polar Surface Area: 52.6?2
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