(5-Bromo-1H-indol-3-yl)acetic acid

CAS Registry Number®

40432-84-6

CAS Name

(5-Bromo-1H-indol-3-yl)acetic acid

Molecular Formula

C10H8BrNO2

Molecular Mass

254.08

Cite this Page

(5-Bromo-1H-indol-3-yl)acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=40432-84-6 (retrieved 2024-11-22) (CAS RN: 40432-84-6).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    144-146 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H8BrNO2/c11-7-1-2-9-8(4-7)6(5-12-9)3-10(13)14/h1-2,4-5,12H,3H2,(H,13,14)

InChIKey

InChIKey=WTFGHMZUJMRWBK-UHFFFAOYSA-N

SMILES

C(C(O)=O)C=1C=2C(NC1)=CC=C(Br)C2

Canonical SMILES

O=C(O)CC1=CNC=2C=CC(Br)=CC21

Other Names for this Substance

  • 1H-Indole-3-acetic acid, 5-bromo-
  • 5-Bromo-1H-indole-3-acetic acid
  • 5-Bromo-IAA
  • 5-Bromo-3-indoleacetic acid
  • 2-(5-Bromo-1H-indol-3-yl)acetic acid

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