Cas no 88129-40-2 (Methyl 3-Formyl-1-methyl-1H-indole-2-carboxylate)

Methyl 3-Formyl-1-methyl-1H-indole-2-carboxylate is a versatile indole derivative widely used in organic synthesis and pharmaceutical research. Its key structural features include a formyl group at the 3-position and a methyl ester at the 2-position, making it a valuable intermediate for constructing complex heterocyclic compounds. The compound's reactivity allows for further functionalization, enabling applications in medicinal chemistry, particularly in the development of bioactive molecules. Its stability under standard conditions and high purity make it suitable for precise synthetic workflows. Researchers favor this compound for its consistent performance in nucleophilic additions, condensations, and other transformations critical to indole-based scaffold elaboration.
Methyl 3-Formyl-1-methyl-1H-indole-2-carboxylate structure
88129-40-2 structure
Product Name:Methyl 3-Formyl-1-methyl-1H-indole-2-carboxylate
CAS No:88129-40-2
MF:C12H11NO3
MW:217.220643281937
MDL:MFCD07364648
CID:644036
PubChem ID:4777797
Update Time:2025-10-17

Methyl 3-Formyl-1-methyl-1H-indole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • 1H-Indole-2-carboxylic acid, 3-formyl-1-methyl-, methyl ester
    • 1H-INDOLE-2-CARBOXYLIC ACID,3-FORMYL-1-,METHYL ESTER
    • Methyl 3-formyl-1-methyl-1H-indole-2-carboxylate
    • 3-Formyl-1-methyl-1H-indole-2-carboxylic acid methyl ester
    • FT-0695942
    • 88129-40-2
    • AKOS004119670
    • VS-10015
    • methyl 3-formyl-1-methylindole-2-carboxylate
    • MFCD07364648
    • DB-322952
    • BBL030750
    • STL372987
    • Methyl 3-Formyl-1-methyl-1H-indole-2-carboxylate
    • MDL: MFCD07364648
    • Inchi: 1S/C12H11NO3/c1-13-10-6-4-3-5-8(10)9(7-14)11(13)12(15)16-2/h3-7H,1-2H3
    • InChI Key: MAWKFBYSXNWFSD-UHFFFAOYSA-N
    • SMILES: O(C)C(C1=C(C=O)C2C=CC=CC=2N1C)=O

Computed Properties

  • Exact Mass: 217.07389321g/mol
  • Monoisotopic Mass: 217.07389321g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 292
  • 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: 1.6
  • Topological Polar Surface Area: 48.3?2

Methyl 3-Formyl-1-methyl-1H-indole-2-carboxylate Pricemore >>

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