Cas no 88733-45-3 (Butanedioic acid, 2,3-diethyl-2,3-diphenyl-)

Butanedioic acid, 2,3-diethyl-2,3-diphenyl- structure
88733-45-3 structure
Product Name:Butanedioic acid, 2,3-diethyl-2,3-diphenyl-
CAS No:88733-45-3
MF:C20H22O4
MW:326.386286258698
CID:622856
PubChem ID:71319879
Update Time:2025-04-19

Butanedioic acid, 2,3-diethyl-2,3-diphenyl- Chemical and Physical Properties

Names and Identifiers

    • Butanedioic acid, 2,3-diethyl-2,3-diphenyl-
    • 2,3-diethyl-2,3-diphenylbutanedioic acid
    • DTXSID50749871
    • 88733-45-3
    • Inchi: 1S/C20H22O4/c1-3-19(17(21)22,15-11-7-5-8-12-15)20(4-2,18(23)24)16-13-9-6-10-14-16/h5-14H,3-4H2,1-2H3,(H,21,22)(H,23,24)
    • InChI Key: ZLQGHAYJGLRTEH-UHFFFAOYSA-N
    • SMILES: OC(C(C1C=CC=CC=1)(CC)C(C(=O)O)(C1C=CC=CC=1)CC)=O

Computed Properties

  • Exact Mass: 326.15180918g/mol
  • Monoisotopic Mass: 326.15180918g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 4
  • Heavy Atom Count: 24
  • Rotatable Bond Count: 7
  • Complexity: 407
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 2
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4
  • Topological Polar Surface Area: 74.6?2
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