Cas no 101737-73-9 (1,4-Benzenediacetonitrile, 2,5-dibutoxy-)

1,4-Benzenediacetonitrile, 2,5-dibutoxy- structure
101737-73-9 structure
Product Name:1,4-Benzenediacetonitrile, 2,5-dibutoxy-
CAS No:101737-73-9
MF:C18H24N2O2
MW:300.395364761353
CID:1134718
Update Time:2024-07-27

1,4-Benzenediacetonitrile, 2,5-dibutoxy- Chemical and Physical Properties

Names and Identifiers

    • 1,4-Benzenediacetonitrile, 2,5-dibutoxy-
    • Inchi: 1S/C18H24N2O2/c1-3-5-11-21-17-13-16(8-10-20)18(22-12-6-4-2)14-15(17)7-9-19/h13-14H,3-8,11-12H2,1-2H3
    • InChI Key: CXSBMZQXCCZWGC-UHFFFAOYSA-N
    • SMILES: C1(CC#N)=CC(OCCCC)=C(CC#N)C=C1OCCCC

Computed Properties

  • Exact Mass: 300.18392

Experimental Properties

  • Density: 1.039±0.06 g/cm3(Predicted)
  • Melting Point: 106-107 °C
  • Boiling Point: 463.6±40.0 °C(Predicted)
  • PSA: 66.04
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