Cas no 5457-02-3 (2,2,4,4-Pentanetetracarboxylicacid, 3-(2-methylpropyl)-, 1,2,4,4-tetramethyl ester)

2,2,4,4-Pentanetetracarboxylicacid, 3-(2-methylpropyl)-, 1,2,4,4-tetramethyl ester structure
5457-02-3 structure
Product Name:2,2,4,4-Pentanetetracarboxylicacid, 3-(2-methylpropyl)-, 1,2,4,4-tetramethyl ester
CAS No:5457-02-3
MF:C15H24O8
MW:332.346265792847
CID:380371
PubChem ID:228449
Update Time:2025-04-19

2,2,4,4-Pentanetetracarboxylicacid, 3-(2-methylpropyl)-, 1,2,4,4-tetramethyl ester Chemical and Physical Properties

Names and Identifiers

    • 2,2,4,4-Pentanetetracarboxylicacid, 3-(2-methylpropyl)-, 1,2,4,4-tetramethyl ester
    • NSC21386; AC1L5G8I; AC1Q5YQ8; CTK5A1708; AR-1L6494; NSC-21386; AG-J-67984; 2,2,4,4-Pentanetetracarboxylicacid, 3-(2-methylpropyl)-, 1,2,4,4-tetramethyl ester;
    • tetramethyl 2-(2-methylpropyl)propane-1,1,3,3-tetracarboxylate
    • NSC21386
    • DTXSID60281358
    • NSC-21386
    • 5457-02-3
    • Inchi： 1S/C15H24O8/c1-8(2)7-9(10(12(16)20-3)13(17)21-4)11(14(18)22-5)15(19)23-6/h8-11H,7H2,1-6H3
    • InChI Key： ISKYJZZYFSFGOC-UHFFFAOYSA-N
    • SMILES： O(C)C(C(C(=O)OC)C(C(C(=O)OC)C(=O)OC)CC(C)C)=O

Computed Properties

  • Exact Mass: 332.14712
  • Monoisotopic Mass: 332.14711772g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 8
  • Heavy Atom Count: 23
  • Rotatable Bond Count: 12
  • Complexity: 375
  • 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
  • XLogP3: 2.2
  • Topological Polar Surface Area: 105?2

Experimental Properties

  • PSA: 105.2
  • LogP: 0.57310

2,2,4,4-Pentanetetracarboxylicacid, 3-(2-methylpropyl)-, 1,2,4,4-tetramethyl ester Related Literature

5457-02-3 (2,2,4,4-Pentanetetracarboxylicacid, 3-(2-methylpropyl)-, 1,2,4,4-tetramethyl ester) Related Products

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