ACETIC ACID, [3-[[5-CHLORO-3-ETHYL-2(3H)-BENZOTHIAZOLYLIDENE]METHYL]-2-CYCLOHEXEN-1-YLIDENE]CYANO-, ETHYL ESTER

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Names

[ CAS No. ]:
55952-71-1

[ Name ]:
ACETIC ACID, [3-[[5-CHLORO-3-ETHYL-2(3H)-BENZOTHIAZOLYLIDENE]METHYL]-2-CYCLOHEXEN-1-YLIDENE]CYANO-, ETHYL ESTER

[Synonym ]:
Formamide,N-[3-(5-bromo-2-pyridinyl)-2-propynyl]
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InChI=1/C9H7BrN2O/c10-8-3-4-9(12-6-8)2-1-5-11-7-13/h3-4,6-7H,5H2,(H,11,13)
[3-(5-chloro-3-ethyl-3H-benzothiazol-2-ylidenemethyl)-cyclohex-2-enylidene]-cyano-acetic acid ethyl ester
[3-(5-bromopyridin-2-yl)prop-2-yn-1-yl]formamide

Chemical & Physical Properties

[ Density]:
1.33g/cm3

[ Boiling Point ]:
524.4ºC at 760 mmHg

[ Molecular Formula ]:
C21H21ClN2O2S

[ Molecular Weight ]:
400.92200

[ Flash Point ]:
270.9ºC

[ Exact Mass ]:
400.10100

[ PSA ]:
83.26000

[ LogP ]:
4.93128

[ Index of Refraction ]:
1.658

Synthetic Route

Click to get detail synthetic route

Precursor & DownStream

Precursor

  • 5-chloro-3-ethyl-2-(3-methoxy-cyclohex-2-enylidenemethyl)-benzothiazolium, iodide
  • Ethyl cyanoacetate

DownStream

Related Compounds

  • 5-Methoxy-5-methylhex-1-yne
  • Benzo[d]thiazol-6-yl(4-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazin-1-yl)methanone
  • 2-(Benzo[d]isoxazol-3-yl)-1-(4-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazin-1-yl)ethanone
  • 3-(3,5-Dimethylisoxazol-4-yl)-1-(4-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazin-1-yl)propan-1-one
  • Benzo[d][1,3]dioxol-5-yl(4-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazin-1-yl)methanone
  • [1,2,4]Triazolo[1,5-a]pyrimidin-2-yl(4-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazin-1-yl)methanone
  • 2-(4-Isopropylphenoxy)-1-(4-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazin-1-yl)ethanone
  • 2-(Benzylthio)-1-(4-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazin-1-yl)ethanone
  • Furan-2-yl(4-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazin-1-yl)methanone
  • 3-(4-(3-methyl-[1,2,4]triazolo[4,3-a]pyrazin-8-yl)piperazine-1-carbonyl)-2H-chromen-2-one
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