510734
6-Chloro-3-pyridinecarbonitrile
97%
Synonym(s):
2-Chloro-5-cyanopyridine, 2-Chloropyridine-5-carbonitrile
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About This Item
Empirical Formula (Hill Notation):
C6H3ClN2
CAS Number:
Molecular Weight:
138.55
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
Form:
solid
InChI
1S/C6H3ClN2/c7-6-2-1-5(3-8)4-9-6/h1-2,4H
SMILES string
Clc1ccc(cn1)C#N
InChI key
ORIQLMBUPMABDV-UHFFFAOYSA-N
assay
97%
form
solid
mp
116-120 °C (lit.)
functional group
chloro, nitrile
Quality Level
General description
6-Chloro-3-pyridinecarbonitrile is a substituted pyridine.
Application
6-Chloro-3-pyridinecarbonitrile (2-Chloro-5-cyanopyridine) may be used in the preparation of:
- (6-chloro-3-pyridyl)methylamine
- 2-(N-methyl-N-isopropylamino)-5-cyanopyridine
- S-(5-cyano-2-pyridyl)thiouronium chloride
signalword
Warning
Hazard Classifications
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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An experimental test of CN bond twisting in the TICT state: syn-anti photoisomerization in 2-(N-Methyl-N-isopropylamino)-5-cyanopyridine.
Dobkowski J, et al.
Journal of the American Chemical Society, 124(11), 2406-2407 (2002)
Practical Synthesis of (6-Chloro-3-pyridyl) methylamine by Highly Selective Hydrogenation of 6-Chloro-3-pyridinecarbonitrile with Improved Raney Nickel Catalyst.
Tanaka K, et al.
Bulletin of the Chemical Society of Japan, 73(5), 1227-1231 (2000)
Chemotherapeutic agents of the sulphone type. Part V. 2: 5-Disubstituted derivatives of pyridine.
Forrest HS and Walker J.
Journal of the Chemical Society, 1939-1945 (1948)
Bachir Latli et al.
Journal of labelled compounds & radiopharmaceuticals (2018-05-17)
1-(4-Fluorophenyl)-1H-pyrazolo[3,4-c]pyridine-4-carboxylic acid (2-methanesulfonyl-pyridin-4-ylmethyl)-amide (1) and its analogs (2) and (3) are potent CCR1 antagonists intended for the treatment of rheumatoid arthritis. The detailed syntheses of these 3 compounds labeled with carbon-13 as well as the preparation of (1) and (2)
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