Cas no 155220-86-3 (Piperidine, 2-methyl-1-[(4-methylphenyl)sulfonyl]-, (2R)-)

Piperidine, 2-methyl-1-[(4-methylphenyl)sulfonyl]-, (2R)- structure
155220-86-3 structure
Product Name:Piperidine, 2-methyl-1-[(4-methylphenyl)sulfonyl]-, (2R)-
CAS No:155220-86-3
MF:C13H19NO2S
MW:253.360462427139
CID:1329876
Update Time:2024-08-18

Piperidine, 2-methyl-1-[(4-methylphenyl)sulfonyl]-, (2R)- Chemical and Physical Properties

Names and Identifiers

    • Piperidine, 2-methyl-1-[(4-methylphenyl)sulfonyl]-, (2R)-
    • Inchi: 1S/C13H19NO2S/c1-11-6-8-13(9-7-11)17(15,16)14-10-4-3-5-12(14)2/h6-9,12H,3-5,10H2,1-2H3/t12-/m1/s1
    • InChI Key: KBTVSWYPEPWISA-GFCCVEGCSA-N
    • SMILES: N1(S(C2=CC=C(C)C=C2)(=O)=O)CCCC[C@H]1C

Computed Properties

  • Exact Mass: 253.11377

Experimental Properties

  • Density: 1.146±0.06 g/cm3(Predicted)
  • Melting Point: 61-62 °C(Solv: ligroine (8032-32-4); ethyl acetate (141-78-6))
  • Boiling Point: 373.8±35.0 °C(Predicted)
  • PSA: 37.38
  • pka: -4.45±0.40(Predicted)

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