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

  • (2-Azabicyclo[4.1.0]heptan-5-yl)methanol hydrochloride
  • tert-Butyl (2-amino-5-oxaspiro[3.5]nonan-9-yl)carbamate
  • Benzyl 6-oxo-5,6-dihydro-1H-pyrazolo[3,4-d]pyrimidine-1-carboxylate
  • N-(1-((2R,3S,3aR,4aR,5aR,5bS)-5a-(Bis(4-methoxyphenyl)(phenyl)methoxy)-3-fluoro-3a-hydroxyoctahydrocyclopropa[4,5]cyclopenta[1,2-b]furan-2-yl)-5-methyl-2-oxo-1,2-dihydropyrimidin-4-yl)benzamide
  • 1-(6,6-Difluorobicyclo[3.1.0]hexan-3-yl)ethanamine
  • 5-((6-Methyl-2,6-diazaspiro[3.3]heptan-2-yl)methyl)isoindoline dihydrochloride
  • Ethyl 2-bromo-6-dodecylthieno[3,2-b]thiophene-3-carboxylate
  • (2R,3S,4R,5R)-2-((Bis(4-methoxyphenyl)(phenyl)methoxy)methyl)-5-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)-4-hydroxytetrahydrofuran-3-yl (2-cyanoethyl) diisopropylphosphoramidite
  • 1-(Bromomethyl)-1,4-difluorocyclohexane
  • (S)-Benzyl 1-((2S,3S)-2-(5-(3-ethoxy-3-oxopropyl)-4-formyl-3-hydroxypicolinamido)-3-methylpentanoyl)pyrrolidine-2-carboxylate
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