Cas no 25781-56-0 (Ethanedioic acid, bis(2-hydroxyethyl) ester)

Ethanedioic acid, bis(2-hydroxyethyl) ester structure
25781-56-0 structure
Product Name:Ethanedioic acid, bis(2-hydroxyethyl) ester
CAS No:25781-56-0
MF:C6H10O6
MW:178.140002727509
CID:238424
PubChem ID:21923986
Update Time:2025-04-19

Ethanedioic acid, bis(2-hydroxyethyl) ester Chemical and Physical Properties

Names and Identifiers

    • Ethanedioic acid, bis(2-hydroxyethyl) ester
    • bis(2-hydroxyethyl) oxalate
    • DTXSID00620186
    • Bis(2-hydroxyethyl) ethanedioate
    • SCHEMBL468011
    • 25781-56-0
    • Inchi: 1S/C6H10O6/c7-1-3-11-5(9)6(10)12-4-2-8/h7-8H,1-4H2
    • InChI Key: DGQWBBVMFRJVQF-UHFFFAOYSA-N
    • SMILES: O(C(C(=O)OCCO)=O)CCO

Computed Properties

  • Exact Mass: 178.0477
  • Monoisotopic Mass: 178.04773803g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 7
  • Complexity: 136
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: -1.5
  • Topological Polar Surface Area: 93.1?2

Experimental Properties

  • PSA: 93.06

Ethanedioic acid, bis(2-hydroxyethyl) ester Related Literature

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