1H-Indole-3-propanoic acid

CAS Registry Number®

830-96-6

CAS Name

1H-Indole-3-propanoic acid

Molecular Formula

C11H11NO2

Molecular Mass

189.21

Cite this Page

1H-Indole-3-propanoic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=830-96-6 (retrieved 2024-11-22) (CAS RN: 830-96-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    134-135 °C

Source(s)

  • (1) PhysProp data were obtained from Syracuse Research Corporation of Syracuse, New York (US)

Other Names and Identifiers

InChI

InChI=1S/C11H11NO2/c13-11(14)6-5-8-7-12-10-4-2-1-3-9(8)10/h1-4,7,12H,5-6H2,(H,13,14)

InChIKey

InChIKey=GOLXRNDWAUTYKT-UHFFFAOYSA-N

SMILES

C(CC(O)=O)C=1C=2C(NC1)=CC=CC2

Canonical SMILES

O=C(O)CCC1=CNC=2C=CC=CC21

Other Names for this Substance

  • 1H-Indole-3-propanoic acid
  • Indole-3-propionic acid
  • 3-(3-Indolyl)propionic acid
  • β-(3-Indolyl)propionic acid
  • β-Indole-3-propionic acid

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