5-Chloroindole-3-acetic acid

CAS Registry Number®

1912-45-4
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CAS Name

5-Chloroindole-3-acetic acid

Molecular Formula

C10H8ClNO2

Molecular Mass

209.63

Cite this Page

5-Chloroindole-3-acetic acid.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=1912-45-4 (retrieved 2024-05-17) (CAS RN: 1912-45-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    158-159 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H8ClNO2/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=ZEIRLSDFVXNFGG-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

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

Other Names for this Substance

  • 1H-Indole-3-acetic acid, 5-chloro-
  • Indole-3-acetic acid, 5-chloro-
  • 5-Chloro-1H-indole-3-acetic acid
  • 5-Chloroindole-3-acetic acid
  • 5-Chloro-IAA

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