301655
4-Pyridylacetonitrile hydrochloride
98%
Synonym(s):
4-Pyridineacetonitrile hydrochloride
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About This Item
Empirical Formula (Hill Notation):
C7H6N2 · HCl
CAS Number:
Molecular Weight:
154.60
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
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Assay
98%
form
solid
mp
267 °C (dec.) (lit.)
SMILES string
Cl[H].N#CCc1ccncc1
InChI
1S/C7H6N2.ClH/c8-4-1-7-2-5-9-6-3-7;/h2-3,5-6H,1H2;1H
InChI key
UBYQSEXKPQZPCN-UHFFFAOYSA-N
General description
Acylation reaction of 4-pyridylacetonitrile hydrochloride has been reported.
Application
4-Pyridylacetonitrile hydrochloride was used in preparation of (2Z)-3-(4-hydroxyphenyl)-4-pyridin-4-ylacrylonitrile.
Signal Word
Warning
Hazard Statements
Precautionary Statements
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 Code
11 - Combustible Solids
WGK
WGK 3
Flash Point(F)
Not applicable
Flash Point(C)
Not applicable
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
Regulatory Information
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Acylation and other reactions of 2-and 4-pyridylacetonitrile.
Gutsche CD and Voges HW.
The Journal of Organic Chemistry, 32(9), 2685-2689 (1967)
Synthesis and X-ray structural analysis of (2Z)-3 (4-hydroxyphenyl)-2-pyridin-4-ylacrylonitrile and (2Z)-3-(3, 5-di-tert-butyl-4-hydroxyphenyl) 2-pyridin-4-ylacrylonitrile.
Helvenston MC, et al.
Journal of Chemical Crystallography, 35(2), 113-118 (2005)
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