Cas no 63468-08-6 (1,2,4-Benzenetricarboxylic Acid 2-(2-ethylhexyl) Ester)

1,2,4-Benzenetricarboxylic Acid 2-(2-ethylhexyl) Ester structure
63468-08-6 structure
Product Name:1,2,4-Benzenetricarboxylic Acid 2-(2-ethylhexyl) Ester
CAS No:63468-08-6
MF:C17H22O6
MW:322.352985858917
CID:1073324
PubChem ID:21245359
Update Time:2025-04-20

1,2,4-Benzenetricarboxylic Acid 2-(2-ethylhexyl) Ester Chemical and Physical Properties

Names and Identifiers

    • 1,2,4-Benzenetricarboxylic Acid 2-(2-ethylhexyl) Ester
    • 2-{[(2-ethylhexyl)oxy]carbonyl}benzene-1,4-dicarboxylic acid
    • SCHEMBL174632
    • G64468
    • starbld0008907
    • 2-(2-ethylhexoxycarbonyl)terephthalic acid
    • 63468-08-6
    • 2-(((2-Ethylhexyl)oxy)carbonyl)terephthalic acid
    • Inchi： 1S/C17H22O6/c1-3-5-6-11(4-2)10-23-17(22)14-9-12(15(18)19)7-8-13(14)16(20)21/h7-9,11H,3-6,10H2,1-2H3,(H,18,19)(H,20,21)
    • InChI Key： HFPLODPJOPAAKB-UHFFFAOYSA-N
    • SMILES： O(C(C1C=C(C(=O)O)C=CC=1C(=O)O)=O)CC(CC)CCCC

Computed Properties

  • Exact Mass: 322.14163842g/mol
  • Monoisotopic Mass: 322.14163842g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 10
  • Complexity: 419
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 1
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • XLogP3: 4
  • Topological Polar Surface Area: 101?2

Experimental Properties

  • Color/Form: NA
  • Flash Point: 145.1±30.7 °C

1,2,4-Benzenetricarboxylic Acid 2-(2-ethylhexyl) Ester Security Information

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Related Categories No. Product Name Cas No. Purity Specification Price update time Inquiry
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