Cas no 61948-77-4 (Benzonitrile, 2,3,4-trimethoxy-6-nitro-)

Benzonitrile, 2,3,4-trimethoxy-6-nitro- structure
61948-77-4 structure
Product Name:Benzonitrile, 2,3,4-trimethoxy-6-nitro-
CAS No:61948-77-4
MF:C10H10N2O5
MW:238.196802616119
CID:1634787
Update Time:2024-09-11

Benzonitrile, 2,3,4-trimethoxy-6-nitro- Chemical and Physical Properties

Names and Identifiers

    • Benzonitrile, 2,3,4-trimethoxy-6-nitro-
    • Inchi: 1S/C10H10N2O5/c1-15-8-4-7(12(13)14)6(5-11)9(16-2)10(8)17-3/h4H,1-3H3
    • InChI Key: AHWRSUHLXJOUDZ-UHFFFAOYSA-N
    • SMILES: C(#N)C1=C([N+]([O-])=O)C=C(OC)C(OC)=C1OC

Computed Properties

  • Exact Mass: 238.059

Experimental Properties

  • Density: 1.33±0.1 g/cm3(Predicted)
  • Melting Point: 118-119 °C(Solv: ethanol (64-17-5))
  • Boiling Point: 433.2±45.0 °C(Predicted)
  • PSA: 94.62
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