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Substance Name: Indole-2-carboxylic acid
RN: 1477-50-5
InChIKey: HCUARRIEZVDMPT-UHFFFAOYSA-N

Note

  • Glycine antagonist.

Molecular Formula

  • C9-H7-N-O2

Molecular Weight

  • 161.159
 
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Names and Synonyms

Name of Substance

  • Indole-2-carboxylic acid

Synonyms

  • 2-Carboxyindole
  • 2-Indolecarboxylic acid
  • EINECS 216-030-4
  • NSC 16598

Systematic Names

  • 1H-Indole-2-carboxylic acid (9CI)
  • Indole-2-carboxylic acid

Registry Numbers

CAS Registry Number

  • 1477-50-5

System Generated Number

  • 0001477505

Structure Descriptors

InChI

1S/C9H7NO2/c11-9(12)8-5-6-3-1-2-4-7(6)10-8/h1-5,10H,(H,11,12)

InChIKey

HCUARRIEZVDMPT-UHFFFAOYSA-N

Smiles

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

Physical Properties

Physical Property Value Units Temp (deg C) Source
Melting Point 205-208 deg C   EXP
log P (octanol-water) 2.31 (none)   EXP
Water Solubility 720 mg/L 25 EST
Vapor Pressure 1.21E-05 mm Hg 25 EST
Henry's Law Constant 1.78E-11 atm-m3/mole 25 EST
Atmospheric OH Rate Constant 4.13E-11 cm3/molecule-sec 25 EST

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