Cas no 887501-25-9 (Benzoyl chloride, 3,4,5-tris(3,6,9,12-tetraoxatridec-1-yloxy)-)

Benzoyl chloride, 3,4,5-tris(3,6,9,12-tetraoxatridec-1-yloxy)- structure
887501-25-9 structure
Product Name:Benzoyl chloride, 3,4,5-tris(3,6,9,12-tetraoxatridec-1-yloxy)-
CAS No:887501-25-9
MF:C34H59ClO16
MW:759.275672197342
CID:622305
PubChem ID:59591500
Update Time:2025-04-19

Benzoyl chloride, 3,4,5-tris(3,6,9,12-tetraoxatridec-1-yloxy)- Chemical and Physical Properties

Names and Identifiers

    • Benzoyl chloride, 3,4,5-tris(3,6,9,12-tetraoxatridec-1-yloxy)-
    • 3,4,5-tris[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]benzoyl chloride
    • 887501-25-9
    • DTXSID50732445
    • 3,4,5-Tris[(2,5,8,11-tetraoxatridecan-13-yl)oxy]benzoyl chloride
    • SCHEMBL13035920
    • Inchi: 1S/C34H59ClO16/c1-37-4-7-40-10-13-43-16-19-46-22-25-49-31-28-30(34(35)36)29-32(50-26-23-47-20-17-44-14-11-41-8-5-38-2)33(31)51-27-24-48-21-18-45-15-12-42-9-6-39-3/h28-29H,4-27H2,1-3H3
    • InChI Key: JGNVRJQGMZCGQH-UHFFFAOYSA-N
    • SMILES: ClC(C1C=C(C(=C(C=1)OCCOCCOCCOCCOC)OCCOCCOCCOCCOC)OCCOCCOCCOCCOC)=O

Computed Properties

  • Exact Mass: 758.3491635g/mol
  • Monoisotopic Mass: 758.3491635g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 16
  • Heavy Atom Count: 51
  • Rotatable Bond Count: 40
  • Complexity: 705
  • 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: 0.6
  • Topological Polar Surface Area: 156?2
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