Cas no 141038-14-4 (2,4-Pentanedione, 3-[2-(3-methoxyphenyl)ethyl]-)

2,4-Pentanedione, 3-[2-(3-methoxyphenyl)ethyl]- structure
141038-14-4 structure
Product Name:2,4-Pentanedione, 3-[2-(3-methoxyphenyl)ethyl]-
CAS No:141038-14-4
MF:C14H18O3
MW:234.290924549103
CID:1308911
Update Time:2024-08-04

2,4-Pentanedione, 3-[2-(3-methoxyphenyl)ethyl]- Chemical and Physical Properties

Names and Identifiers

    • 2,4-Pentanedione, 3-[2-(3-methoxyphenyl)ethyl]-
    • Inchi: 1S/C14H18O3/c1-10(15)14(11(2)16)8-7-12-5-4-6-13(9-12)17-3/h4-6,9,14H,7-8H2,1-3H3
    • InChI Key: XINNHKMFLIUGNU-UHFFFAOYSA-N
    • SMILES: CC(=O)C(CCC1=CC=CC(OC)=C1)C(=O)C

Computed Properties

  • Exact Mass: 234.12564

Experimental Properties

  • Density: 1.048±0.06 g/cm3(Predicted)
  • Boiling Point: 377.1±37.0 °C(Predicted)
  • PSA: 43.37
  • pka: 10.46±0.59(Predicted)
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