MilliporeSigma
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156744

Sigma-Aldrich

1-Chloroisoquinoline

95%

Empirical Formula (Hill Notation):
C9H6ClN
CAS Number:
Molecular Weight:
163.60
MDL number:
PubChem Substance ID:
NACRES:
NA.22

Quality Level

assay

95%

bp

274-275 °C/768 mmHg (lit.)

mp

31-36 °C (lit.)

SMILES string

Clc1nccc2ccccc12

InChI

1S/C9H6ClN/c10-9-8-4-2-1-3-7(8)5-6-11-9/h1-6H

InChI key

MSQCQINLJMEVNJ-UHFFFAOYSA-N

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Application

The product has been used in a Mn-catalyzed cross-coupling with aryl- and alkylmagnesium halides. It has also been used in a Pd-catalyzed cross-coupling with heteroaryl boronic acids and esters. Furthermore, it has been used in a homocoupling reaction to yield bis-isoquinoline, each enantiomer of which might be very useful as a chiral ligand for asymmetric synthesis.

Packaging

1, 5 g in glass bottle

Pictograms

Exclamation mark

Signal Word

Warning

Hazard Statements

Hazard Classifications

Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

Target Organs

Respiratory system

Storage Class Code

11 - Combustible Solids

WGK

WGK 3

Personal Protective Equipment

dust mask type N95 (US), Eyeshields, Gloves

Certificate of Analysis

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Certificate of Origin

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