Cas no 95264-40-7 (Ethyl 4,6-dimethyl-1H-indole-2-carboxylate)

Ethyl 4,6-dimethyl-1H-indole-2-carboxylate structure
95264-40-7 structure
Product Name:Ethyl 4,6-dimethyl-1H-indole-2-carboxylate
CAS No:95264-40-7
MF:C13H15NO2
MW:217.263703584671
MDL:MFCD04966970
CID:1084710
PubChem ID:4714990
Update Time:2025-04-20

Ethyl 4,6-dimethyl-1H-indole-2-carboxylate Chemical and Physical Properties

Names and Identifiers

    • Ethyl 4,6-dimethyl-1H-indole-2-carboxylate
    • 4,6-DIMETHYL-1H-INDOLE-2-CARBOXYLIC ACID ETHYL ESTER
    • Z293150490
    • MFCD04966970
    • SCHEMBL1761178
    • 95264-40-7
    • AKOS001476261
    • AB01328255-02
    • FT-0717915
    • MMFBMAHZFBCFMJ-UHFFFAOYSA-N
    • EN300-65520
    • ethyl4,6-dimethyl-1H-indole-2-carboxylate
    • CS-0256879
    • NCGC00335646-01
    • G37717
    • WS-03244
    • STK893303
    • BBL020613
    • DA-33941
    • 1H-Indole-2-carboxylic acid, 4,6-dimethyl-, ethyl ester
    • MDL: MFCD04966970
    • Inchi: 1S/C13H15NO2/c1-4-16-13(15)12-7-10-9(3)5-8(2)6-11(10)14-12/h5-7,14H,4H2,1-3H3
    • InChI Key: MMFBMAHZFBCFMJ-UHFFFAOYSA-N
    • SMILES: O(CC)C(C1=CC2C(C)=CC(C)=CC=2N1)=O

Computed Properties

  • Exact Mass: 217.110278721g/mol
  • Monoisotopic Mass: 217.110278721g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 1
  • Hydrogen Bond Acceptor Count: 3
  • Heavy Atom Count: 16
  • Rotatable Bond Count: 3
  • Complexity: 267
  • 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: 1.2±0.1 g/cm3
  • Melting Point: 119-121 °C
  • Boiling Point: 363.0±37.0 °C at 760 mmHg
  • Flash Point: 173.3±26.5 °C
  • Vapor Pressure: 0.0±0.8 mmHg at 25°C

Ethyl 4,6-dimethyl-1H-indole-2-carboxylate Security Information

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