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Substance Name: Ethyl indole-2-carboxylate
RN: 3770-50-1
InChIKey: QQXQAEWRSVZPJM-UHFFFAOYSA-N

Molecular Formula

  • C11-H11-N-O2

Molecular Weight

  • 189.213
 
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Names and Synonyms

Synonyms

  • 2-Carbethoxyindole
  • EINECS 223-206-4
  • Ethyl 1H-indole-2-carboxylate
  • Ethyl indole-2-carboxylate
  • NSC 10076

Systematic Names

  • 1H-Indole-2-carboxylic acid, ethyl ester (9CI)
  • Ethyl indole-2-carboxylate
  • Indole-2-carboxylic acid, ethyl ester (8CI)

Registry Numbers

CAS Registry Number

  • 3770-50-1

System Generated Number

  • 0003770501

Structure Descriptors

InChI

1S/C11H11NO2/c1-2-14-11(13)10-7-8-5-3-4-6-9(8)12-10/h3-7,12H,2H2,1H3

InChIKey

QQXQAEWRSVZPJM-UHFFFAOYSA-N

Smiles

c1([nH]c2ccccc2c1)C(=O)OCC

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 122-125 deg C   EXP
log P (octanol-water) 3.22 (none)   EXP
Water Solubility 88.2 mg/L 25 EST
Vapor Pressure 8.33E-05 mm Hg 25 EST
Henry's Law Constant 7.58E-09 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 3.72E-11 cm3/molecule-sec 25 EST

Physical property data is provided to ChemIDplus by SRC, Inc.