1H-Indole-3-carboxylic acid, 5-chloro-, methyl ester

CAS Registry Number®

172595-67-4

CAS Name

1H-Indole-3-carboxylic acid, 5-chloro-, methyl ester

Molecular Formula

C10H8ClNO2

Molecular Mass

209.63

Cite this Page

1H-Indole-3-carboxylic acid, 5-chloro-, methyl ester.   CAS Common Chemistry.   CAS, a division of the American Chemical Society, n.d.   http://commonchemistry.cas.org/detail?cas_rn=172595-67-4 (retrieved 2024-11-25) (CAS RN: 172595-67-4).  Licensed under the Attribution-Noncommercial 4.0 International License (CC BY-NC 4.0).

Compound Properties

  • Melting Point (1)

    196-198 °C

Source(s)

Other Names and Identifiers

InChI

InChI=1S/C10H8ClNO2/c1-14-10(13)8-5-12-9-3-2-6(11)4-7(8)9/h2-5,12H,1H3

InChIKey

InChIKey=QFNXAQPCYKEICY-UHFFFAOYSA-N

SMILES

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

Canonical SMILES

O=C(OC)C1=CNC=2C=CC(Cl)=CC21

Other Names for this Substance

  • 1H-Indole-3-carboxylic acid, 5-chloro-, methyl ester
  • 5-Chloro-3-methoxycarbonyl-1H-indole
  • Methyl 5-chloro-1H-indole-3-carboxylate

CAS INSIGHTSTM
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