Cas no 88770-20-1 (Methyl 5-Iodothiophene-3-carboxylate)

Methyl 5-Iodothiophene-3-carboxylate is a versatile heterocyclic compound widely used in organic synthesis and pharmaceutical research. Its key advantages include its role as a valuable intermediate in the preparation of thiophene-based derivatives, which are essential in medicinal chemistry and material science. The iodine substituent at the 5-position enhances reactivity, enabling efficient cross-coupling reactions such as Suzuki or Sonogashira couplings. The ester functional group at the 3-position offers further derivatization potential, making it a flexible building block for complex molecules. Its stability under standard storage conditions and well-characterized properties ensure reliable performance in synthetic applications. This compound is particularly useful in the development of agrochemicals, pharmaceuticals, and functional materials.
Methyl 5-Iodothiophene-3-carboxylate structure
88770-20-1 structure
Product Name:Methyl 5-Iodothiophene-3-carboxylate
CAS No:88770-20-1
MF:C6H5IO2S
MW:268.072172880173
MDL:MFCD23722994
CID:1935381
PubChem ID:53584713
Update Time:2025-05-27

Methyl 5-Iodothiophene-3-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 3-Thiophenecarboxylic acid, 5-iodo-, methyl ester
    • methyl 5-iodothiophene-3-carboxylate
    • SCHEMBL15057183
    • ACAMEEQCWLGHQW-UHFFFAOYSA-N
    • Z1153249243
    • 88770-20-1
    • EN300-344735
    • DA-32298
    • Methyl5-iodothiophene-3-carboxylate
    • AKOS017385607
    • MFCD23722994
    • 5-Iodo-thiophene-3-carboxylic acid methyl ester
    • Methyl 5-Iodothiophene-3-carboxylate
    • MDL： MFCD23722994
    • Inchi： 1S/C6H5IO2S/c1-9-6(8)4-2-5(7)10-3-4/h2-3H,1H3
    • InChI Key： ACAMEEQCWLGHQW-UHFFFAOYSA-N
    • SMILES： IC1=CC(C(=O)OC)=CS1

Computed Properties

  • Exact Mass: 267.90550Da
  • Monoisotopic Mass: 267.90550Da
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 2
  • Heavy Atom Count: 10
  • Rotatable Bond Count: 2
  • Complexity: 140
  • 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: 2.1
  • Topological Polar Surface Area: 54.5?2

Methyl 5-Iodothiophene-3-carboxylate Pricemore >>

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