ethyl 2-[1-(2-amino-2-sulfanylideneethyl)pyrrolidin-2-ylidene]-2-cyanoacetate

Names

[ CAS No. ]:
111038-09-6

[ Name ]:
ethyl 2-[1-(2-amino-2-sulfanylideneethyl)pyrrolidin-2-ylidene]-2-cyanoacetate

[Synonym ]:
Acetic acid,2-[1-(2-amino-2-thioxoethyl)-2-pyrrolidinylidene]-2-cyano-,ethyl ester
Aceticacid,[1-(2-amino-2-thioxoethyl)-2-pyrrolidinylidene]cyano-,ethyl ester (9CI)
1-Thiocarbamidomethyl-2-(2'-cyano-2'-ethoxycarbonyl)methylenepyrrolidine

Chemical & Physical Properties

[ Density]:
1.28g/cm3

[ Boiling Point ]:
412.9ºC at 760mmHg

[ Molecular Formula ]:
C11H15N3O2S

[ Molecular Weight ]:
253.32100

[ Flash Point ]:
203.5ºC

[ Exact Mass ]:
253.08800

[ PSA ]:
115.98000

[ LogP ]:
1.36768

[ Vapour Pressure ]:
5E-07mmHg at 25°C

[ Index of Refraction ]:
1.588

Synthetic Route

Precursor & DownStream

Precursor

  • ethyl 2-[1-(2-amino-2-oxoethyl)pyrrolidin-2-ylidene]-2-cyanoacetate
  • 1-Cyanomethyl-2-(2'-cyano-2'-ethoxycarbonyl)methylenepyrrolidine
  • 2-(2,2-diethoxypyrrolidin-1-yl)acetonitrile
  • Ethyl cyanoacetate

DownStream

  • ethyl (2E)-2-cyano-2-[1-[((Z)-dimethylaminomethylidenethiocarbamoyl)me thyl]pyrrolidin-2-ylidene]acetate