Cas no 169674-00-4 (Methyl 6-chloro-5-fluoro-1H-indole-2-carboxylate)

Methyl 6-chloro-5-fluoro-1H-indole-2-carboxylate structure
169674-00-4 structure
Product Name:Methyl 6-chloro-5-fluoro-1H-indole-2-carboxylate
CAS No:169674-00-4
MF:C11H9ClFNO2
MW:241.646065473557
CID:65834
PubChem ID:18986240
Update Time:2025-04-18

Methyl 6-chloro-5-fluoro-1H-indole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Methyl 6-chloro-5-fluoro-1H-indole-2-carboxylate
    • 6-Chloro-5-fluoro-1H-indole-2-carboxylic acid ethyl ester
    • METHYL 5-FLUORO-6-CHOLRO-1H-INDOLE-2-CARBOXYLATE
    • ethyl 6-chloro-5-fluoro-1H-indole-2-carboxylate
    • Ethyl 6-chloro-5-fluoroindole-2-carboxylate
    • I10-0381
    • KITAYCDBMMPIMA-UHFFFAOYSA-N
    • 1H-Indole-2-carboxylicacid, 6-chloro-5-fluoro-, ethyl ester
    • F75455
    • 169674-00-4
    • AC-5210
    • AKOS025402113
    • BS-52032
    • ethyl6-chloro-5-fluoro-1H-indole-2-carboxylate
    • CS-0448072
    • SCHEMBL3276358
    • Methyl 6-chloro-5-fluoro-1H-indole-2-carboxylate
    • MDL: MFCD03094955
    • Inchi: 1S/C11H9ClFNO2/c1-2-16-11(15)10-4-6-3-8(13)7(12)5-9(6)14-10/h3-5,14H,2H2,1H3
    • InChI Key: KITAYCDBMMPIMA-UHFFFAOYSA-N
    • SMILES: ClC1C(=CC2C=C(C(=O)OCC)NC=2C=1)F

Computed Properties

  • Exact Mass: 241.03100
  • Monoisotopic Mass: 241.0305844g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 277
  • 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: 3.3
  • Topological Polar Surface Area: 42.1?2

Experimental Properties

  • Density: 1.401
  • Boiling Point: 380.6 °C at 760 mmHg
  • Flash Point: 380.6 °C at 760 mmHg
  • Refractive Index: 1.61
  • PSA: 42.09000
  • LogP: 3.13710

Methyl 6-chloro-5-fluoro-1H-indole-2-carboxylate Pricemore >>

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