Cas no 1255098-87-3 (Methyl 5-chloro-7-fluoro-1h-indole-2-carboxylate)

Methyl 5-chloro-7-fluoro-1h-indole-2-carboxylate structure
1255098-87-3 structure
Product Name:Methyl 5-chloro-7-fluoro-1h-indole-2-carboxylate
CAS No:1255098-87-3
MF:C10H7ClFNO2
MW:227.619485139847
CID:2157380
PubChem ID:53403245
Update Time:2024-11-02

Methyl 5-chloro-7-fluoro-1h-indole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 5-chloro-7-fluoro-1h-indole-2-carboxylate
    • DTXSID00695152
    • 1255098-87-3
    • MFCD17926304
    • DB-101372
    • XIVIFWHIIZITDS-UHFFFAOYSA-N
    • SCHEMBL16235908
    • SY346223
    • METHYL5-CHLORO-7-FLUORO-1H-INDOLE-2-CARBOXYLATE
    • MDL: MFCD17926304
    • Inchi: 1S/C10H7ClFNO2/c1-15-10(14)8-3-5-2-6(11)4-7(12)9(5)13-8/h2-4,13H,1H3
    • InChI Key: XIVIFWHIIZITDS-UHFFFAOYSA-N
    • SMILES: ClC1C=C(C2=C(C=1)C=C(C(=O)OC)N2)F

Computed Properties

  • Exact Mass: 227.0149343g/mol
  • Monoisotopic Mass: 227.0149343g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 15
  • Rotatable Bond Count: 2
  • Complexity: 264
  • 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: 3
  • Topological Polar Surface Area: 42.1?2

Methyl 5-chloro-7-fluoro-1h-indole-2-carboxylate Pricemore >>

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