Synthesis and Crystal Structure of 2-tert-Butyl-5-(4-tert-butylbenzylthio)- 4-chloropyridazin-3 (2H) -one

The title compound, 2-ten-butyl-6 (4-ten -butylbenzylthio) -4-chloropyridazin-3 ( 2H ) -one, was synthesized from 1 -ten-butylhydrazine, ( Z ) -2,3 -dichloro-3 -formylacrylic acid and ( 4 -tert -butylphenyl ) methanethiol in several steps. It crystallized in an orthorhombic space group Pnma with Mr...

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Veröffentlicht in:Chemical research in Chinese universities 2006, Vol.22 (6), p.763-764
1. Verfasser: XU Liang-zhong YU Guan-ping XU Zhong-jie ZHANG Gong-sheng ZHAI Zhi-wei
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Sprache:eng
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Zusammenfassung:The title compound, 2-ten-butyl-6 (4-ten -butylbenzylthio) -4-chloropyridazin-3 ( 2H ) -one, was synthesized from 1 -ten-butylhydrazine, ( Z ) -2,3 -dichloro-3 -formylacrylic acid and ( 4 -tert -butylphenyl ) methanethiol in several steps. It crystallized in an orthorhombic space group Pnma with Mr = 364. 93 ( C19H25 ClN2OS), a = 1. 0091 (2) nm, b = 0.7076(2) nm, c=2. 8103(5) nm, V=2.0066(6) nm^3, Z=4, Dc =1. 192 g/cm^3, F(000) =765, μ=0.301 mm , final R1 = 0. 0665, and wR = 0. 1913 for 1927 unique reflections. Inter- and intramolecular hydrogen bond C-H…O interactions stabilize the structure.
ISSN:1005-9040
2210-3171