Cas no 1233086-44-6 (1-tert-Butyl 2-ethyl 5-methyl-1H-indole-1,2-dicarboxylate)

1-tert-Butyl 2-ethyl 5-methyl-1H-indole-1,2-dicarboxylate structure
1233086-44-6 structure
Product Name:1-tert-Butyl 2-ethyl 5-methyl-1H-indole-1,2-dicarboxylate
CAS No:1233086-44-6
MF:C17H21NO4
MW:303.35294508934
CID:823161
PubChem ID:57347182
Update Time:2025-04-19

1-tert-Butyl 2-ethyl 5-methyl-1H-indole-1,2-dicarboxylate Chemical and Physical Properties

Names and Identifiers

    • 1-tert-Butyl 2-ethyl 5-methyl-1H-indole-1,2-dicarboxylate
    • 1-O-tert-butyl 2-O-ethyl 5-methylindole-1,2-dicarboxylate
    • 1-tert-Butyl 2-ethyl 5-methylindole-1,2-dicarboxylate
    • AG-L-59617
    • AK141390
    • CTK4B3453
    • QC-8178
    • 1233086-44-6
    • WS-02232
    • CS-0140338
    • SCHEMBL12042732
    • Ethyl 1-Boc-5-methyl-1h-indole-2-carboxylate
    • 1-t-Butyl 2-ethyl 5-methyl-1H-indole-1,2-dicarboxylate
    • E71242
    • 1H-Indole-1,2-dicarboxylic acid, 5-methyl-, 1-(1,1-dimethylethyl) 2-ethyl ester
    • AKOS015995028
    • DTXSID80721387
    • AC-26885
    • 1-(tert-butyl) 2-ethyl 5-methyl-1H-indole-1,2-dicarboxylate
    • DB-238313
    • 1-tert-butyl2-ethyl5-methyl-1H-indole-1,2-dicarboxylate
    • MFCD21606645
    • MDL: MFCD21606645
    • Inchi: 1S/C17H21NO4/c1-6-21-15(19)14-10-12-9-11(2)7-8-13(12)18(14)16(20)22-17(3,4)5/h7-10H,6H2,1-5H3
    • InChI Key: GTUBBFJXLFYUAS-UHFFFAOYSA-N
    • SMILES: O(C(N1C(C(=O)OCC)=CC2C=C(C)C=CC1=2)=O)C(C)(C)C

Computed Properties

  • Exact Mass: 303.14705815g/mol
  • Monoisotopic Mass: 303.14705815g/mol
  • Isotope Atom Count: 0
  • Hydrogen Bond Donor Count: 0
  • Hydrogen Bond Acceptor Count: 5
  • Heavy Atom Count: 22
  • Rotatable Bond Count: 6
  • Complexity: 429
  • 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: 4.2
  • Topological Polar Surface Area: 57.5?2

Experimental Properties

  • Density: 1.12±0.1 g/cm3 (20 oC 760 Torr),
  • Solubility: Insuluble (9.7E-4 g/L) (25 oC),

1-tert-Butyl 2-ethyl 5-methyl-1H-indole-1,2-dicarboxylate Pricemore >>

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