Cas no 639070-82-9 (2-Propanone, 1-(4-ethylphenyl)-1-hydroxy-, (1S)-)

2-Propanone, 1-(4-ethylphenyl)-1-hydroxy-, (1S)- structure
639070-82-9 structure
Product Name:2-Propanone, 1-(4-ethylphenyl)-1-hydroxy-, (1S)-
CAS No:639070-82-9
MF:C11H14O2
MW:178.227663516998
CID:1662488
Update Time:2024-09-12

2-Propanone, 1-(4-ethylphenyl)-1-hydroxy-, (1S)- Chemical and Physical Properties

Names and Identifiers

    • 2-Propanone, 1-(4-ethylphenyl)-1-hydroxy-, (1S)-
    • Inchi: 1S/C11H14O2/c1-3-9-4-6-10(7-5-9)11(13)8(2)12/h4-7,11,13H,3H2,1-2H3/t11-/m1/s1
    • InChI Key: FTASTXBTRPOGFC-LLVKDONJSA-N
    • SMILES: [C@@H](C1=CC=C(CC)C=C1)(O)C(=O)C

Computed Properties

  • Exact Mass: 178.09942

Experimental Properties

  • Density: 1.067±0.06 g/cm3(Predicted)
  • Boiling Point: 291.8±25.0 °C(Predicted)
  • PSA: 37.3
  • pka: 12.45±0.20(Predicted)

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