Cas no 63808-95-7 (1-Octanone, 1-[1,1':4',1''-terphenyl]-4-yl-)

1-Octanone, 1-[1,1':4',1''-terphenyl]-4-yl- structure
63808-95-7 structure
Product Name:1-Octanone, 1-[1,1':4',1''-terphenyl]-4-yl-
CAS No:63808-95-7
MF:C26H28O
MW:356.499927520752
CID:1658974
Update Time:2024-09-12

1-Octanone, 1-[1,1':4',1''-terphenyl]-4-yl- Chemical and Physical Properties

Names and Identifiers

    • 1-Octanone, 1-[1,1':4',1''-terphenyl]-4-yl-
    • 1-Octanone, 1-[1,1':4',1''-terphenyl]-4-yl- (9CI)
    • Inchi: 1S/C26H28O/c1-2-3-4-5-9-12-26(27)25-19-17-24(18-20-25)23-15-13-22(14-16-23)21-10-7-6-8-11-21/h6-8,10-11,13-20H,2-5,9,12H2,1H3
    • InChI Key: NUVOBSWDVOWZMS-UHFFFAOYSA-N
    • SMILES: C(C1=CC=C(C2=CC=C(C3=CC=CC=C3)C=C2)C=C1)(=O)CCCCCCC

Computed Properties

  • Exact Mass: 356.21414

Experimental Properties

  • Density: 1.016±0.06 g/cm3(Predicted)
  • Melting Point: 198.5 °C (polymorph)
  • Boiling Point: 519.9±19.0 °C(Predicted)
  • PSA: 17.07

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