Cas no 59782-35-3 (2-thiophenecarboxylic acid, 5-tridecyl-)

2-thiophenecarboxylic acid, 5-tridecyl- structure
59782-35-3 structure
Product Name:2-thiophenecarboxylic acid, 5-tridecyl-
CAS No:59782-35-3
MF:C18H30O2S
MW:310.494604587555
CID:1616945
Update Time:2024-08-29

2-thiophenecarboxylic acid, 5-tridecyl- Chemical and Physical Properties

Names and Identifiers

    • 2-thiophenecarboxylic acid, 5-tridecyl-
    • 5-Tridecylthiophene-2-carboxylic acid
    • LogP
    • Inchi: 1S/C18H30O2S/c1-2-3-4-5-6-7-8-9-10-11-12-13-16-14-15-17(21-16)18(19)20/h14-15H,2-13H2,1H3,(H,19,20)
    • InChI Key: RZPVFVREUAHBOQ-UHFFFAOYSA-N
    • SMILES: C1(C(O)=O)SC(CCCCCCCCCCCCC)=CC=1

Computed Properties

  • Exact Mass: 310.1968

Experimental Properties

  • Density: 1.015
  • Melting Point: 91-92 °C(Solv: acetone (67-64-1); hexane (110-54-3))
  • Boiling Point: 434.856°C at 760 mmHg
  • Flash Point: 216.793°C
  • Refractive Index: 1.514
  • PSA: 37.3
  • pka: 3.71±0.10(Predicted)

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