Cas no 121405-10-5 (Benzonitrile, 4-[(R)-methylsulfinyl]-)

Benzonitrile, 4-[(R)-methylsulfinyl]- structure
121405-10-5 structure
Product Name:Benzonitrile, 4-[(R)-methylsulfinyl]-
CAS No:121405-10-5
MF:C8H7NOS
MW:165.212280511856
CID:1216635
Update Time:2024-08-05

Benzonitrile, 4-[(R)-methylsulfinyl]- Chemical and Physical Properties

Names and Identifiers

    • Benzonitrile, 4-[(R)-methylsulfinyl]-
    • 4-[(R)-methylsulfinyl]benzonitrile
    • Inchi: 1S/C8H7NOS/c1-11(10)8-4-2-7(6-9)3-5-8/h2-5H,1H3/t11-/m1/s1
    • InChI Key: ZKFYBOCMRDEHJS-LLVKDONJSA-N
    • SMILES: C(#N)C1=CC=C([S@@](C)=O)C=C1

Computed Properties

  • Exact Mass: 165.02491

Experimental Properties

  • Density: 1.30±0.1 g/cm3(Predicted)
  • Boiling Point: 356.1±25.0 °C(Predicted)
  • PSA: 40.86

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