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Home > Encyclopedia > 2-ACETYL-3-AMINO-3-(METHYLTHIO)ACRYLONITRILE

2-ACETYL-3-AMINO-3-(METHYLTHIO)ACRYLONITRILE

2-ACETYL-3-AMINO-3-(METHYLTHIO)ACRYLONITRILE structure

2-ACETYL-3-AMINO-3-(METHYLTHIO)ACRYLONITRILE 

structure
  • CAS No:

    58955-39-8

  • Formula:

    C6H8N2OS

  • Chemical Name:

    2-ACETYL-3-AMINO-3-(METHYLTHIO)ACRYLONITRILE

  • Synonyms:

    2-acetyl-3-amino-3-(methylthio)acrylonitrile;2-[amino(methylsulfanyl)methylidene]-3-oxobutanenitrile;CTK5A9143;DTXSID80343205;MCULE-6356642975;DB-004684;FT-0610947;Butanenitrile,2-[amino(methylthio)methylene]-3-oxo-;(E)-2-(amino(methylthio)methylene)-3-oxobutanenitrile

2-ACETYL-3-AMINO-3-(METHYLTHIO)ACRYLONITRILE Basic Attributes

156.21

156.03600

DTXSID80343205

Characteristics

92.18000

1.33258

1.211g/cm3

246°C

365.6ºC at 760 mmHg

174.9ºC

1.549

Safety Information

20/21/22-36/37/38

26-36/37/39

Computed Properties

Molecular Weight:156.21
XLogP3:0.7
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:156.03573406
Monoisotopic Mass:156.03573406
Topological Polar Surface Area:92.2
Heavy Atom Count:10
Complexity:223
Undefined Bond Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes

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