Cas no 101254-09-5 (Pentanoic acid, 5,5'-[1,4-phenylenebis(oxy)]bis-)

Pentanoic acid, 5,5'-[1,4-phenylenebis(oxy)]bis- structure
101254-09-5 structure
Product Name:Pentanoic acid, 5,5'-[1,4-phenylenebis(oxy)]bis-
CAS No:101254-09-5
MF:C16H22O6
MW:310.342285633087
CID:1131107
Update Time:2024-07-27

Pentanoic acid, 5,5'-[1,4-phenylenebis(oxy)]bis- Chemical and Physical Properties

Names and Identifiers

    • Pentanoic acid, 5,5'-[1,4-phenylenebis(oxy)]bis-
    • Pentanoic acid, 5,5'-[1,4-phenylenebis(oxy)]bis- (9CI)
    • Inchi: 1S/C16H22O6/c17-15(18)5-1-3-11-21-13-7-9-14(10-8-13)22-12-4-2-6-16(19)20/h7-10H,1-6,11-12H2,(H,17,18)(H,19,20)
    • InChI Key: TVFGXSIZJOEYQF-UHFFFAOYSA-N
    • SMILES: C1(OCCCCC(O)=O)=CC=C(OCCCCC(O)=O)C=C1

Computed Properties

  • Exact Mass: 310.14166

Experimental Properties

  • Density: 1.199±0.06 g/cm3(Predicted)
  • Melting Point: 147-150 °C
  • Boiling Point: 552.7±40.0 °C(Predicted)
  • PSA: 93.06
  • pka: 4.38±0.10(Predicted)
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