Cas no 394222-99-2 (Methyl 4,6-difluoro-1H-indole-2-carboxylate)

Methyl 4,6-difluoro-1H-indole-2-carboxylate is a fluorinated indole derivative with significant utility in pharmaceutical and agrochemical research. The presence of fluorine atoms at the 4- and 6-positions enhances its metabolic stability and bioavailability, making it a valuable intermediate for drug discovery. The ester group at the 2-position allows for further functionalization, facilitating the synthesis of diverse heterocyclic compounds. Its well-defined structure and high purity ensure reproducibility in synthetic applications. This compound is particularly useful in the development of bioactive molecules, including kinase inhibitors and antimicrobial agents, due to its electron-withdrawing properties and structural versatility.
Methyl 4,6-difluoro-1H-indole-2-carboxylate structure
394222-99-2 structure
Product Name:Methyl 4,6-difluoro-1H-indole-2-carboxylate
CAS No:394222-99-2
MF:C10H7F2NO2
MW:211.164889574051
MDL:MFCD09042156
CID:1084701
PubChem ID:16768506
Update Time:2025-06-06

Methyl 4,6-difluoro-1H-indole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4,6-difluoro-1H-indole-2-carboxylate
    • methyl-4,6-difluoroindole-carboxylate
    • TD1381
    • DB-230766
    • methyl4,6-difluoro-1H-indole-2-carboxylate
    • methyl 4,6-difluoroindole-2-carboxylate
    • SB15133
    • MFCD09042156
    • EN300-35641
    • A873656
    • AKOS000123985
    • 394222-99-2
    • SCHEMBL4276853
    • Z336087984
    • MDL： MFCD09042156
    • Inchi： 1S/C10H7F2NO2/c1-15-10(14)9-4-6-7(12)2-5(11)3-8(6)13-9/h2-4,13H,1H3
    • InChI Key： OQBNNAMXCZSCFC-UHFFFAOYSA-N
    • SMILES： FC1=CC(=CC2=C1C=C(C(=O)OC)N2)F

Computed Properties

  • Exact Mass: 211.04451
  • Monoisotopic Mass: 211.04448479g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 262
  • 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: 2.4
  • Topological Polar Surface Area: 42.1?2

Experimental Properties

  • PSA: 42.09

Methyl 4,6-difluoro-1H-indole-2-carboxylate Pricemore >>

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Methyl 4,6-difluoro-1H-indole-2-carboxylate Suppliers

Amadis Chemical Company Limited
Gold Member
Audited Supplier Audited Supplier
(CAS:394222-99-2)Methyl 4,6-difluoro-1H-indole-2-carboxylate
Order Number:A873656
Stock Status:in Stock
Quantity:1g
Purity:99%
Pricing Information Last Updated:Friday, 30 August 2024 09:40
Price ($):342.0

Methyl 4,6-difluoro-1H-indole-2-carboxylate Related Literature

394222-99-2 (Methyl 4,6-difluoro-1H-indole-2-carboxylate) Related Products

Recommended suppliers
Amadis Chemical Company Limited
(CAS:394222-99-2)Methyl 4,6-difluoro-1H-indole-2-carboxylate
A873656
Purity:99%
Quantity:1g
Price ($):342.0
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