362360
3-Methoxyacrylonitrile, mixture of isomers
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About This Item
Linear Formula:
CH3OCH=CHCN
CAS Number:
Molecular Weight:
83.09
MDL number:
UNSPSC Code:
12352100
PubChem Substance ID:
NACRES:
NA.22
form
liquid
refractive index
n20/D 1.455 (lit.)
density
0.99 g/mL at 25 °C (lit.)
SMILES string
COC=CC#N
InChI
1S/C4H5NO/c1-6-4-2-3-5/h2,4H,1H3
InChI key
IPCRTSDORDQHRO-UHFFFAOYSA-N
Application
3-Methoxyacrylonitrile may be used in the synthesis of 5-amino-1-hydroxyethylpyrazole, an intermediate of cefoselis sulfate. It may be used in the synthesis of 3-aminoacrylonitrile, an important intermediate for the synthesis of biologically active substances.2
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
10 - Combustible liquids
WGK
WGK 3
Flash Point(F)
168.8 °F - closed cup
Flash Point(C)
76 °C - closed cup
Personal Protective Equipment
dust mask type N95 (US), Eyeshields, Gloves
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Synthesis of 5-Amino-1-hydroxyethylpyrazole.
Zhon Y and Wu B.
Chinese Journal of Pharmaceuticals / Chung-kuo i yao kung yeh tsa chih, 34(9), 431-432 (2003)
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