Cas no 4339-27-9 (1,2,4-Butanetricarboxylicacid, 1,2,4-trimethyl ester)

1,2,4-Butanetricarboxylic acid, 1,2,4-trimethyl ester is a versatile ester derivative of butanetricarboxylic acid, primarily used as an intermediate in organic synthesis and specialty chemical production. Its key advantages include a well-defined molecular structure, which ensures consistent reactivity in esterification and transesterification reactions. The compound's trifunctional nature allows for selective modifications, making it valuable in polymer chemistry and the synthesis of complex organic molecules. Its stability under standard conditions and compatibility with a range of solvents enhance its utility in laboratory and industrial applications. The trimethyl ester group improves solubility and processability, facilitating its use in fine chemical manufacturing.
1,2,4-Butanetricarboxylicacid, 1,2,4-trimethyl ester structure
4339-27-9 structure
Product Name:1,2,4-Butanetricarboxylicacid, 1,2,4-trimethyl ester
CAS No:4339-27-9
MF:C10H16O6
MW:232.230443954468
CID:325272
PubChem ID:543737
Update Time:2025-06-07

1,2,4-Butanetricarboxylicacid, 1,2,4-trimethyl ester Chemical and Physical Properties

Names and Identifiers

    • 1,2,4-Butanetricarboxylicacid, 1,2,4-trimethyl ester
    • 3-methylhexane-2,3,5-tricarboxylic acid
    • Dimethyl 3-(methoxycarbonyl)hexanediate
    • trimethyl butane-1,2,4-tricarboxylate
    • 1,2,4-Butanetricarboxylic acid,trimethyl ester
    • 1,2,4-tricarbomethoxybutane
    • 1,2,4-trimethoxycarbonylbutane
    • Butan-1,2,4-tricarbonsaeure-trimethylester
    • butane-1,2,4-tricarboxylic acid trimethyl ester
    • methylester of 1,2,4-butanetricarboxylic acid
    • Trimethyl 1,2,4-butanetricarboxylate
    • trimethyl 1,2,4-butanetri-carboxylate
    • 4339-27-9
    • DTXSID20337628
    • 1,2,4-tricarbomethoxy butane
    • SCHEMBL526220
    • FT-0753640
    • 1,2,4-Butanetricarboxylic acid, trimethyl ester
    • Trimethyl 1,2,4-butanetricarboxylate #
    • G67562
    • 1,2,4-TRIMETHYL BUTANE-1,2,4-TRICARBOXYLATE
    • DA-05869
    • Inchi： 1S/C10H16O6/c1-14-8(11)5-4-7(10(13)16-3)6-9(12)15-2/h7H,4-6H2,1-3H3
    • InChI Key： DVHJCQNSPXZHEC-UHFFFAOYSA-N
    • SMILES： O(C)C(C(CC(=O)OC)CCC(=O)OC)=O

Computed Properties

  • Exact Mass: 232.09500
  • Monoisotopic Mass: 232.09468823g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 9
  • Complexity: 260
  • 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
  • Surface Charge: 0
  • Tautomer Count: nothing
  • XLogP3: 0.1
  • Topological Polar Surface Area: 78.9?2

Experimental Properties

  • PSA: 78.90000
  • LogP: 0.29190

1,2,4-Butanetricarboxylicacid, 1,2,4-trimethyl ester Pricemore >>

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