Cas no 34774-87-3 (Benzenamine, 4-methyl-2-[(methylthio)methyl]-)

Benzenamine, 4-methyl-2-[(methylthio)methyl]- structure
34774-87-3 structure
Product Name:Benzenamine, 4-methyl-2-[(methylthio)methyl]-
CAS No:34774-87-3
MF:C9H13NS
MW:167.27122092247
CID:1466562
Update Time:2024-08-25

Benzenamine, 4-methyl-2-[(methylthio)methyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, 4-methyl-2-[(methylthio)methyl]-
    • (2-amino-5-methylphenyl)methyl methyl sulphide
    • Inchi: 1S/C9H13NS/c1-7-3-4-9(10)8(5-7)6-11-2/h3-5H,6,10H2,1-2H3
    • InChI Key: IBLFILLNSKNPAX-UHFFFAOYSA-N
    • SMILES: C1(N)=CC=C(C)C=C1CSC

Computed Properties

  • Exact Mass: 167.07699

Experimental Properties

  • Density: 1.080±0.06 g/cm3(Predicted)
  • Boiling Point: 286.7±25.0 °C(Predicted)
  • PSA: 26.02
  • pka: 4.29±0.10(Predicted)
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