Cas no 133-47-1 (Dihydroxyfumaric Acid Dimethyl Ester)

Dihydroxyfumaric Acid Dimethyl Ester is a dimethyl ester derivative of dihydroxyfumaric acid, characterized by its two hydroxyl and two ester functional groups. This compound is of interest in organic synthesis and coordination chemistry due to its ability to act as a chelating ligand, forming stable complexes with metal ions. Its ester groups enhance solubility in organic solvents, facilitating its use in various chemical reactions. The presence of hydroxyl groups allows for further functionalization, making it a versatile intermediate in the preparation of more complex molecules. Its stability under standard conditions and well-defined reactivity profile contribute to its utility in research and industrial applications.
Dihydroxyfumaric Acid Dimethyl Ester structure
133-47-1 structure
Product Name:Dihydroxyfumaric Acid Dimethyl Ester
CAS No:133-47-1
MF:C6H8O6
MW:176.124122619629
CID:36305
PubChem ID:54699194
Update Time:2025-11-02

Dihydroxyfumaric Acid Dimethyl Ester Chemical and Physical Properties

Names and Identifiers

    • (E)-Dimethyl 2,3-dihydroxyfumarate
    • (E)-2,3-Dihydroxy-2-butenedioic acid dimethyl ester
    • methyl (Z)-3,4-dihydroxy-4-methoxy-2-oxo-but-3-enoate
    • DihydroxyfuMaric Acid DiMethyl Ester
    • methyl 3,4-dihydroxy-4-methoxy-2-oxobut-3-enoate
    • Dihydroxy-fumarsaeure-dimethylester
    • Dihydroxy-fumarsaure-dimethylester
    • Dimethyl dihydroxyfumarate
    • Fumaric acid,dihydroxy-,dimethyl ester
    • Hydroxyl-Oxo-Succinic Acid DiMethyl Ester (DHF)
    • 2-Butenedioic acid, 2,3-dihydroxy-, 1,4-dimethyl ester, (2E)-
    • Fumaric acid, dihydroxy-, dimethyl ester
    • Methyl 3,4-dihydroxy-4-methoxy-2-oxobut-3-enoate
    • DHF/Dihydroxyfumaric Acid Dimethyl Ester
    • dimethyl (E)-2,3-dihydroxybut-2-enedioate
    • AMY18044
    • A806622
    • (E)-2,3-dihydroxy-but-2-enedioic acid dimethyl ester
    • HMPNVUONVWQKFY-ONEGZZNKSA-N
    • SCHEMBL823296
    • ?methyl (Z)-3,4-dihydroxy-4-methoxy-2-oxo-but-3-enoate
    • DTXSID101030334
    • (E)-Dimethyl2,3-dihydroxyfumarate
    • 133-47-1
    • dimethyl 2,3-dihydroxyfumarate
    • SCHEMBL3185570
    • Dihydroxy-maleic acid, dimethyl ester
    • DB-029672
    • 1,4-Dimethyl (2E)-2,3-dihydroxy-2-butenedioate
    • Dihydroxyfumaric Acid Dimethyl Ester
    • Inchi: 1S/C6H8O6/c1-11-5(9)3(7)4(8)6(10)12-2/h7-8H,1-2H3/b4-3+
    • InChI Key: HMPNVUONVWQKFY-ONEGZZNKSA-N
    • SMILES: O(C)C(/C(=C(/C(=O)OC)\O)/O)=O

Computed Properties

  • Exact Mass: 176.03200
  • Monoisotopic Mass: 176.032
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 2
  • Hydrogen Bond Acceptor Count: 6
  • Heavy Atom Count: 12
  • Rotatable Bond Count: 4
  • Complexity: 204
  • Covalently-Bonded Unit Count: 1
  • Defined Atom Stereocenter Count: 0
  • Undefined Atom Stereocenter Count : 0
  • Defined Bond Stereocenter Count: 1
  • Undefined Bond Stereocenter Count: 0
  • Topological Polar Surface Area: 93.1A^2
  • XLogP3: 1

Experimental Properties

  • Color/Form: No data available
  • Density: 1.434
  • Melting Point: NA
  • Boiling Point: 304 oC
  • Flash Point: 126 oC
  • Refractive Index: 1.501
  • PSA: 93.06000
  • LogP: -0.34000
  • Vapor Pressure: 0.0±1.4 mmHg at 25°C

Dihydroxyfumaric Acid Dimethyl Ester Customs Data

  • HS CODE:2918199090
  • Customs Data:

    China Customs Code:

    2918199090

    Overview:

    HS: 2918199090. Other alcohol containing but not other oxy carboxylic acids(Including its anhydride\Acyl halide\Peroxides, peroxyacids and derivatives of this tax number). VAT:17.0%. Tax refund rate:9.0%. Regulatory conditions:nothing. MFN tariff:6.5%. general tariff:30.0%

    Declaration elements:

    Product Name, component content, use to

    Summary:

    2918199090 other carboxylic acids with alcohol function but without other oxygen function, their anhydrides, halides, peroxides, peroxyacids and their derivatives.Supervision conditions:None.VAT:17.0%.Tax rebate rate:9.0%.MFN tariff:6.5%.General tariff:30.0%

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