3-phenyl-6-thia-1,4-diazabicyclo[3.3.0]octa-2,4-diene-2-carbonitrile

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Names

[ CAS No. ]:
83253-38-7

[ Name ]:
3-phenyl-6-thia-1,4-diazabicyclo[3.3.0]octa-2,4-diene-2-carbonitrile

[Synonym ]:
hms2683i11
hms1532h09

Chemical & Physical Properties

[ Density]:
1.36g/cm3

[ Boiling Point ]:
511.7ºC at 760 mmHg

[ Molecular Formula ]:
C12H9N3S

[ Molecular Weight ]:
227.28500

[ Flash Point ]:
263.3ºC

[ Exact Mass ]:
227.05200

[ PSA ]:
66.91000

[ LogP ]:
2.52748

[ Index of Refraction ]:
1.733

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • N-[(3-phenyl-6-thia-1,4-diazabicyclo[3.3.0]octa-2,4-dien-2-yl)methylidene]hydroxylamine
  • 6-Phenyl-2,3-dihydroimidazo[2,1-b][1,3]thiazole-5-carbaldehyde

DownStream

  • Imidazo[2,1-b]thiazole-5-carboxamide,2,3-dihydro-6-phenyl-