Cas no 16927-06-3 (1,2,4,5-Benzenetetracarboxylicacid, 1,4-diethyl ester)

1,2,4,5-Benzenetetracarboxylicacid, 1,4-diethyl ester structure
16927-06-3 structure
Product Name:1,2,4,5-Benzenetetracarboxylicacid, 1,4-diethyl ester
CAS No:16927-06-3
MF:C14H14O8
MW:310.256165027618
CID:195133
PubChem ID:85646
Update Time:2025-04-19

1,2,4,5-Benzenetetracarboxylicacid, 1,4-diethyl ester Chemical and Physical Properties

Names and Identifiers

    • 1,2,4,5-Benzenetetracarboxylicacid, 1,4-diethyl ester
    • 2,5-bis(ethoxycarbonyl)terephthalic acid
    • 1,2,4,5-Benzenetetracarboxylic acid, 1,4-diethyl ester
    • DTXSID80884946
    • Diethyl pyromellitate
    • 50853-29-7
    • 16927-06-3
    • SCHEMBL11576424
    • Inchi: 1S/C14H14O8/c1-3-21-13(19)9-5-8(12(17)18)10(14(20)22-4-2)6-7(9)11(15)16/h5-6H,3-4H2,1-2H3,(H,15,16)(H,17,18)
    • InChI Key: FKBDSZNRJFOVHK-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1C=C(C(=O)O)C(C(=O)OCC)=CC=1C(=O)O)=O

Computed Properties

  • Exact Mass: 310.069
  • Monoisotopic Mass: 310.069
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 8
  • Complexity: 416
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 0
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 127A^2
  • XLogP3: 1.4

Experimental Properties

  • Density: 1.389
  • Boiling Point: 539.5°Cat760mmHg
  • Flash Point: 202.9°C
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