Cas no 183663-71-0 (Pentanedioic acid, 2-ethyl-2-(4-nitrophenyl)-)

Pentanedioic acid, 2-ethyl-2-(4-nitrophenyl)- structure
183663-71-0 structure
Product Name:Pentanedioic acid, 2-ethyl-2-(4-nitrophenyl)-
CAS No:183663-71-0
MF:C13H15NO6
MW:281.261304140091
CID:1377564
Update Time:2024-08-14

Pentanedioic acid, 2-ethyl-2-(4-nitrophenyl)- Chemical and Physical Properties

Names and Identifiers

    • Pentanedioic acid, 2-ethyl-2-(4-nitrophenyl)-
    • Inchi: 1S/C13H15NO6/c1-2-13(12(17)18,8-7-11(15)16)9-3-5-10(6-4-9)14(19)20/h3-6H,2,7-8H2,1H3,(H,15,16)(H,17,18)
    • InChI Key: WGYUQHUCMWWQPF-UHFFFAOYSA-N
    • SMILES: C(O)(=O)C(CC)(C1=CC=C([N+]([O-])=O)C=C1)CCC(O)=O

Computed Properties

  • Exact Mass: 281.08995

Experimental Properties

  • Density: 1.360±0.06 g/cm3(Predicted)
  • Boiling Point: 466.4±35.0 °C(Predicted)
  • PSA: 117.74
  • pka: 3.67±0.10(Predicted)
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