177156
3-Quinolinecarbonitrile
98%
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About This Item
Empirical Formula (Hill Notation):
C10H6N2
CAS Number:
Molecular Weight:
154.17
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
EC Number:
252-248-6
MDL number:
Assay:
98%
Form:
powder
Product Name
3-Quinolinecarbonitrile, 98%
InChI key
QZZYYBQGTSGDPP-UHFFFAOYSA-N
InChI
1S/C10H6N2/c11-6-8-5-9-3-1-2-4-10(9)12-7-8/h1-5,7H
SMILES string
N#Cc1cnc2ccccc2c1
assay
98%
form
powder
mp
108-110 °C (lit.)
Quality Level
Related Categories
Application
3-Quinolinecarbonitrile was used as a template for EGFR inhibitors.
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
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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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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