Cas no 104259-10-1 (Benzene, 1,1'-[1,2-ethanediylbis(oxy)]bis[4-isocyanato-)

Benzene, 1,1'-[1,2-ethanediylbis(oxy)]bis[4-isocyanato- structure
104259-10-1 structure
Product Name:Benzene, 1,1'-[1,2-ethanediylbis(oxy)]bis[4-isocyanato-
CAS No:104259-10-1
MF:C16H12N2O4
MW:296.277483940125
CID:1142164
PubChem ID:13668433
Update Time:2025-04-20

Benzene, 1,1'-[1,2-ethanediylbis(oxy)]bis[4-isocyanato- Chemical and Physical Properties

Names and Identifiers

    • Benzene, 1,1'-[1,2-ethanediylbis(oxy)]bis[4-isocyanato-
    • 1-isocyanato-4-[2-(4-isocyanatophenoxy)ethoxy]benzene
    • DTXSID50546261
    • 104259-10-1
    • 1,2-bis(4-isocyanatophenoxy) ethane
    • SCHEMBL10341829
    • 1,1'-[Ethane-1,2-diylbis(oxy)]bis(4-isocyanatobenzene)
    • Inchi: 1S/C16H12N2O4/c19-11-17-13-1-5-15(6-2-13)21-9-10-22-16-7-3-14(4-8-16)18-12-20/h1-8H,9-10H2
    • InChI Key: CWAXXUGHGOPFIZ-UHFFFAOYSA-N
    • SMILES: O(C1C=CC(=CC=1)N=C=O)CCOC1C=CC(=CC=1)N=C=O

Computed Properties

  • Exact Mass: 296.07970687g/mol
  • Monoisotopic Mass: 296.07970687g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 7
  • Complexity: 374
  • 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: 5.2
  • Topological Polar Surface Area: 77.3?2
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