2-Acetyl-3-amino-3-(methylthio)acrylonitrile

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Catalog Number
ACM58955398
Product Name
2-Acetyl-3-amino-3-(methylthio)acrylonitrile
Structure
Structure
CAS
58955-39-8
Category
Heterocyclic Organic Compound
Synonyms
2-ACETYL-3-AMINO-3-(METHYLTHIO)ACRYLONITRILE;1-AMINO-2-CYANO-1-(METHYLTHIO)BUT-1-EN-3-ONE;1-Amino-2-cyano-1-methylthio-1-buten-3-one
IUPAC Name
2-[amino(methylsulfanyl)methylidene]-3-oxobutanenitrile
Molecular Weight
156.21
Molecular Formula
C6H8N2OS
Canonical SMILES
CC(=O)C(=C(N)SC)C#N
InChI Key
SQFSYOPZMBCRNE-UHFFFAOYSA-N
Boiling Point
365.6ºC at 760 mmHg
Melting Point
246ºC
Flash Point
174.9ºC
Density
1.211g/cm³
Exact Mass
156.03600
H-Bond Acceptor
4
H-Bond Donor
1
Safety Description
26-36/37/39
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