Cas no 138964-41-7 (1H-Pyrrole, 3-(4-methylphenyl)-4-nitro-)

1H-Pyrrole, 3-(4-methylphenyl)-4-nitro- structure
138964-41-7 structure
Product Name:1H-Pyrrole, 3-(4-methylphenyl)-4-nitro-
CAS No:138964-41-7
MF:C11H10N2O2
MW:202.209302425385
CID:1257750
Update Time:2024-08-04

1H-Pyrrole, 3-(4-methylphenyl)-4-nitro- Chemical and Physical Properties

Names and Identifiers

    • 1H-Pyrrole, 3-(4-methylphenyl)-4-nitro-
    • Inchi: 1S/C11H10N2O2/c1-8-2-4-9(5-3-8)10-6-12-7-11(10)13(14)15/h2-7,12H,1H3
    • InChI Key: FASYXYYODDXEBV-UHFFFAOYSA-N
    • SMILES: N1C=C([N+]([O-])=O)C(C2=CC=C(C)C=C2)=C1

Computed Properties

  • Exact Mass: 202.0743

Experimental Properties

  • Density: 1.254±0.06 g/cm3(Predicted)
  • Boiling Point: 380.0±30.0 °C(Predicted)
  • PSA: 58.93
  • pka: 13.70±0.50(Predicted)

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