3-Aminocrotononitrile, (E)+(Z), 96%, Thermo Scientific Chemicals

Description

3-Aminocrotononitrile reacts with ferrocenyl-1,2-enones to form ferrocenyl pyridines. It undergoes diazotization coupling reaction with p-substituted anilines to give 2-arylhydrazone-3-ketimino-butyronitriles.3-Aminocrotononitrile, (E)+(Z), is used in reaction with aryldiazonium salts gave, instead of the expected triazene, 2-arylhydrazono-3-ketobutyronitrile by electrophilic attack at the ?-carbon and hydrolysis of the resulting imine. It is also used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff. 3-Aminocrotononitrile was used as bisnucleophilic reagent which on cyclocondensation with hexafluoroacetone(ethoxycarbonylimine) forms bis(trifluoromethyl)pyrimidinones.

This Thermo Scientific Chemicals brand product was originally part of the Alfa Aesar product portfolio. Some documentation and label information may refer to the legacy brand. The original Alfa Aesar product / item code or SKU reference has not changed as a part of the brand transition to Thermo Scientific Chemicals.

Applications
3-Aminocrotononitrile reacts with ferrocenyl-1,2-enones to form ferrocenyl pyridines. It undergoes diazotization coupling reaction with p-substituted anilines to give 2-arylhydrazone-3-ketimino-butyronitriles.3-Aminocrotononitrile, (E)+(Z), is used in reaction with aryldiazonium salts gave, instead of the expected triazene, 2-arylhydrazono-3-ketobutyronitrile by electrophilic attack at the ɑ-carbon and hydrolysis of the resulting imine. It is also used as an important raw material and intermediate used in organic Synthesis, pharmaceuticals, agrochemicals and dyestuff. 3-Aminocrotononitrile was used as bisnucleophilic reagent which on cyclocondensation with hexafluoroacetone(ethoxycarbonylimine) forms bis(trifluoromethyl)pyrimidinones.

Solubility
Very soluble in water, soluble in ethanol.

Notes
Store in cool place. Keep container tightly closed in a dry and well-ventilated place. Keep away from oxidizing agents.

Specifications

Chemical Identifiers

• CAS: 1118-61-2
• Molecular Formula: C4H6N2
• Molecular Weight (g/mol): 82.11
• MDL Number: MFCD00008071,MFCD00008071
• InChI Key: DELJOESCKJGFML-DUXPYHPUSA-N
• Synonym: 3-aminocrotononitrile, 2z-3-aminobut-2-enenitrile, 3-amino-2-butenenitrile, z-3-aminobut-2-enenitrile, beta-aminocrotononitrile, 3-amino-2-butenonitrile, 2-amino-1-propenecarbonitrile, 3-amino-crotononitrile, beta-amino-crotononitrile, 2z-3-amino-2-butenenitrile
• PubChem CID: 5325263
• IUPAC Name: (Z)-3-aminobut-2-enenitrile
• SMILES: C\C(N)=C/C#N

• Melting Point: ∼70°C to 75°C
• Boiling Point: 120°C (4 mmHg)
• Flash Point: 154°C (309°F)
• Quantity: 500 g
• Beilstein: 1719815
• Solubility Information: Very soluble in water,soluble in ethanol.
• Formula Weight: 82.11
• Percent Purity: 96%
• Chemical Name or Material: 3-Aminocrotononitrile, (E)+(Z)

Safety and Handling

Hazard Category	H302+H332-H317
Precautionary Statement	P261-P264b-P270-P271-P272-P280g-P301+P312-P302+P352-P304+P340-P312-P330-P333+P313-P363-P501c
DOTInformation	Hazard Class: 6.1; Packaging Group: III
EINECSNumber	214-266-2
TSCA	Yes
Recommended Storage	Keep cold

SDS

RUO – Research Use Only