Cas no 19089-23-7 (Pentanamide, 2-bromo-5-chloro-N-(2,4,6-trimethylphenyl)-)

Pentanamide, 2-bromo-5-chloro-N-(2,4,6-trimethylphenyl)- structure
19089-23-7 structure
Product Name:Pentanamide, 2-bromo-5-chloro-N-(2,4,6-trimethylphenyl)-
CAS No:19089-23-7
MF:C14H19BrClNO
MW:332.663762331009
CID:1384843
Update Time:2024-08-16

Pentanamide, 2-bromo-5-chloro-N-(2,4,6-trimethylphenyl)- Chemical and Physical Properties

Names and Identifiers

    • Pentanamide, 2-bromo-5-chloro-N-(2,4,6-trimethylphenyl)-
    • Inchi: 1S/C14H19BrClNO/c1-9-7-10(2)13(11(3)8-9)17-14(18)12(15)5-4-6-16/h7-8,12H,4-6H2,1-3H3,(H,17,18)
    • InChI Key: SHIMENFJDWZAGV-UHFFFAOYSA-N
    • SMILES: C(NC1=C(C)C=C(C)C=C1C)(=O)C(Br)CCCCl

Computed Properties

  • Exact Mass: 331.03397

Experimental Properties

  • Density: 1.353±0.06 g/cm3(Predicted)
  • Boiling Point: 411.8±45.0 °C(Predicted)
  • PSA: 29.1
  • pka: 12.95±0.70(Predicted)
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