272469
2-Cyanothioacetamide
97%
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About This Item
Linear Formula:
NCCH2CSNH2
CAS Number:
Molecular Weight:
100.14
NACRES:
NA.22
PubChem Substance ID:
UNSPSC Code:
12352100
MDL number:
Assay:
97%
Form:
solid
Quality Level
assay
97%
form
solid
mp
118-120 °C (lit.)
functional group
amine, nitrile
SMILES string
NC(=S)CC#N
InChI
1S/C3H4N2S/c4-2-1-3(5)6/h1H2,(H2,5,6)
InChI key
BHPYMZQTCPRLNR-UHFFFAOYSA-N
Application
2-Cyanothioacetamide was used in the synthesis of 3,4-trans-4-aryl-3-(1-pyridinio)-1,2,3,4-tetrahydropyridine-6-thiolates and bis[6-(2-aryl)-2-thioxo-1,2-dihydropyridine-3-carbonitrile]. It was also used as a building block for 2-pyridothiones.
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
6.1C - Combustible acute toxic Cat.3 / toxic compounds or compounds which causing chronic effects
wgk
WGK 3
flash_point_f
Not applicable
flash_point_c
Not applicable
ppe
dust mask type N95 (US), Eyeshields, Gloves
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Liebigs Ann. Chem., 213-213 (1984)
Liebigs Ann. Chem., 210-210 (1986)
Farag M A Altalbawy
International journal of molecular sciences, 14(2), 2967-2979 (2013-02-01)
The title compounds were prepared by reaction of 1,1'-(5-methyl-1-phenyl-1H-pyrazole-3,4-diyl)diethanone (1) with different aromatic aldehydes 2a-c, namely Furfural (2a), 4-chlorobenzaldehyde (2b) and 4-methoxybenzaldhyde (2c) to yield the corresponding α,β-unsaturated ketones 3a-c. Compound 3 was reacted with malononitrile, 2-cyanoacetamide or 2-cyanothioacetamide yielded
Global Trade Item Number
| SKU | GTIN |
|---|---|
| 272469-25G | 04061826144282 |
| 272469-5G | 04061833464953 |