Cas no 313337-35-8 (Methyl 4-fluoro-1H-indole-7-carboxylate)

Methyl 4-fluoro-1H-indole-7-carboxylate is a fluorinated indole derivative with a carboxylate ester functional group at the 7-position. This compound serves as a valuable intermediate in pharmaceutical and agrochemical synthesis, particularly in the development of bioactive molecules. The presence of the fluorine substituent at the 4-position enhances its reactivity and potential for further functionalization, making it useful in medicinal chemistry applications. The ester group provides versatility for hydrolysis or further derivatization. Its structural features contribute to its utility in constructing heterocyclic frameworks, often employed in drug discovery. The compound is typically handled under standard laboratory conditions, requiring appropriate storage to maintain stability.
Methyl 4-fluoro-1H-indole-7-carboxylate structure
313337-35-8 structure
Product Name:Methyl 4-fluoro-1H-indole-7-carboxylate
CAS No:313337-35-8
MF:C10H8FNO2
MW:193.174426078796
MDL:MFCD11845610
CID:1036400
PubChem ID:22473012
Update Time:2025-06-07

Methyl 4-fluoro-1H-indole-7-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 4-fluoro-1H-indole-7-carboxylate
    • Methyl4-fluoro-1H-indole-7-carboxylate
    • AKOS016000900
    • DS-5892
    • DTXSID60625894
    • SCHEMBL5258354
    • CS-0042872
    • P11208
    • HEQXLRSGYSDTAZ-UHFFFAOYSA-N
    • MFCD11845610
    • 4-fluoro-7-carbomethoxy indole
    • 4-Fluoro-7-indole carboxylic acid methyl ester
    • 313337-35-8
    • Methyl 4-Fluoroindole-7-carboxylate
    • SY128756
    • 4-FLUORO-1H-INDOLE-7-CARBOXYLIC ACID METHYL ESTER
    • PB22539
    • methyl (4-fluoro)indole-7-carboxylate
    • DB-334852
    • MDL: MFCD11845610
    • Inchi: 1S/C10H8FNO2/c1-14-10(13)7-2-3-8(11)6-4-5-12-9(6)7/h2-5,12H,1H3
    • InChI Key: HEQXLRSGYSDTAZ-UHFFFAOYSA-N
    • SMILES: FC1=CC=C(C(=O)OC)C2=C1C=CN2

Computed Properties

  • Exact Mass: 193.05394
  • Monoisotopic Mass: 193.05390666g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 14
  • Rotatable Bond Count: 2
  • Complexity: 234
  • 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
  • Topological Polar Surface Area: 42.1?2

Experimental Properties

  • Density: 1.3±0.1 g/cm3
  • Melting Point: N/A℃
  • Boiling Point: 335.6±22.0℃ at 760 mmHg
  • Flash Point: 156.7±22.3 °C
  • PSA: 42.09
  • Vapor Pressure: 0.0±0.7 mmHg at 25°C

Methyl 4-fluoro-1H-indole-7-carboxylate Security Information

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Methyl 4-fluoro-1H-indole-7-carboxylate Suppliers

Amadis Chemical Company Limited
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(CAS:313337-35-8)Methyl 4-fluoro-1H-indole-7-carboxylate
Order Number:A1013106
Stock Status:in Stock
Quantity:5g
Purity:99%
Pricing Information Last Updated:Thursday, 29 August 2024 15:14
Price ($):571.0
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Amadis Chemical Company Limited
(CAS:313337-35-8)Methyl 4-fluoro-1H-indole-7-carboxylate
A1013106
Purity:99%
Quantity:5g
Price ($):571.0
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