Cas no 7324-53-0 (1,2-Propanediol, 3,3'-[1,3-phenylenebis(oxy)]bis-)

1,2-Propanediol, 3,3'-[1,3-phenylenebis(oxy)]bis- structure
7324-53-0 structure
Product Name:1,2-Propanediol, 3,3'-[1,3-phenylenebis(oxy)]bis-
CAS No:7324-53-0
MF:C12H18O6
MW:258.267724514008
CID:530904
PubChem ID:68738846
Update Time:2025-04-19

1,2-Propanediol, 3,3'-[1,3-phenylenebis(oxy)]bis- Chemical and Physical Properties

Names and Identifiers

    • 1,2-Propanediol, 3,3'-[1,3-phenylenebis(oxy)]bis-
    • 3-[3-(2,3-dihydroxypropoxy)phenoxy]propane-1,2-diol
    • 3,3'-[1,3-Phenylenebis(oxy)]di(propane-1,2-diol)
    • SCHEMBL3671328
    • 7324-53-0
    • DTXSID40738931
    • Inchi: 1S/C12H18O6/c13-5-9(15)7-17-11-2-1-3-12(4-11)18-8-10(16)6-14/h1-4,9-10,13-16H,5-8H2
    • InChI Key: PKNQCLIOQMEQOR-UHFFFAOYSA-N
    • SMILES: O(C1C=CC=C(C=1)OCC(CO)O)CC(CO)O

Computed Properties

  • Exact Mass: 258.11033829g/mol
  • Monoisotopic Mass: 258.11033829g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 4
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 18
  • Rotatable Bond Count: 8
  • Complexity: 193
  • 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: -0.7
  • Topological Polar Surface Area: 99.4?2
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