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Sigma-Aldrich

3-Quinolinecarbonitrile

98%

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About This Item

Empirical Formula (Hill Notation):
C10H6N2
CAS Number:
34846-64-5
Molecular Weight:
154.17
EC Number:
252-248-6
MDL number:
MFCD00006766
UNSPSC Code:
12352100
PubChem Substance ID:
24850618
NACRES:
NA.22

Quality Level

100

assay

98%

form

powder

mp

108-110 °C (lit.)

SMILES string

N#Cc1cnc2ccccc2c1

InChI

1S/C10H6N2/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-5,7H

InChI key

QZZYYBQGTSGDPP-UHFFFAOYSA-N

Application

3-Quinolinecarbonitrile was used as a template for EGFR inhibitors.

pictograms

Exclamation mark
GHS07

signalword

Warning

Hazard Classifications

Acute Tox. 4 Dermal - Acute Tox. 4 Inhalation - Acute Tox. 4 Oral - Eye Irrit. 2 - Skin Irrit. 2 - STOT SE 3

target_organs

Respiratory system

Storage Class

11 - Combustible Solids

wgk_germany

WGK 3

flash_point_f

Not applicable

flash_point_c

Not applicable

ppe

dust mask type N95 (US), Eyeshields, Gloves

Certificates of Analysis (COA)

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Diane H Boschelli
Current topics in medicinal chemistry, 8(10), 922-934 (2008-08-05)
In 2000, Wyeth reported that the 3-quinolinecarbonitrile ring system was a template for EGFR inhibitors. It soon became apparent that the group at C-4 of this core was responsible for kinase selectivity. A 4-(2,4-dichloro-5-methoxyanilino) substituent provided potent inhibitors of Src
Tamara Rodríguez-Cabo et al.
Analytical and bioanalytical chemistry, 407(20), 6159-6170 (2015-06-05)
Time-of-flight accurate mass spectrometry (TOF-MS), following a previous chromatographic (gas or liquid chromatography) separation step, is applied to the identification and structural elucidation of quinoline-like alkaloids in honey. Both electron ionization (EI) MS and positive electrospray (ESI+) MS spectra afforded

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