Cas no 178163-46-7 (Benzenemethanamine, 4-bromo-N-methyl-N-(1-methylpropyl)-)

Benzenemethanamine, 4-bromo-N-methyl-N-(1-methylpropyl)- structure
178163-46-7 structure
Product Name:Benzenemethanamine, 4-bromo-N-methyl-N-(1-methylpropyl)-
CAS No:178163-46-7
MF:C12H18BrN
MW:256.182022571564
CID:1365370
Update Time:2024-08-17

Benzenemethanamine, 4-bromo-N-methyl-N-(1-methylpropyl)- Chemical and Physical Properties

Names and Identifiers

    • Benzenemethanamine, 4-bromo-N-methyl-N-(1-methylpropyl)-
    • Inchi: 1S/C12H18BrN/c1-4-10(2)14(3)9-11-5-7-12(13)8-6-11/h5-8,10H,4,9H2,1-3H3
    • InChI Key: YHMULMMPBVDZCY-UHFFFAOYSA-N
    • SMILES: C1(CN(C)C(C)CC)=CC=C(Br)C=C1

Computed Properties

  • Exact Mass: 255.06234

Experimental Properties

  • Density: 1?+-.0.06 g/cm3(Predicted)
  • Boiling Point: 277.4±15.0 °C(Predicted)
  • PSA: 3.24
  • pka: 8.72±0.50(Predicted)
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