Cas no 63996-76-9 (Benzenamine, 4-[[[(4-aminophenyl)methyl]thio]methyl]-3,5-dimethyl-)

Benzenamine, 4-[[[(4-aminophenyl)methyl]thio]methyl]-3,5-dimethyl- structure
63996-76-9 structure
Product Name:Benzenamine, 4-[[[(4-aminophenyl)methyl]thio]methyl]-3,5-dimethyl-
CAS No:63996-76-9
MF:C16H20N2S
MW:272.408402442932
CID:1663531
Update Time:2024-08-30

Benzenamine, 4-[[[(4-aminophenyl)methyl]thio]methyl]-3,5-dimethyl- Chemical and Physical Properties

Names and Identifiers

    • Benzenamine, 4-[[[(4-aminophenyl)methyl]thio]methyl]-3,5-dimethyl-
    • Inchi: 1S/C16H20N2S/c1-11-7-15(18)8-12(2)16(11)10-19-9-13-3-5-14(17)6-4-13/h3-8H,9-10,17-18H2,1-2H3
    • InChI Key: NUCARUMSPHEDTC-UHFFFAOYSA-N
    • SMILES: C1(N)=CC(C)=C(CSCC2=CC=C(N)C=C2)C(C)=C1

Computed Properties

  • Exact Mass: 272.1349

Experimental Properties

  • Density: 1.163±0.06 g/cm3(Predicted)
  • Melting Point: 82-84 °C(Solv: ethyl ether (60-29-7); hexane (110-54-3))
  • Boiling Point: 468.3±40.0 °C(Predicted)
  • PSA: 52.04
  • pka: 4.71±0.10(Predicted)
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