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ChemicalBook--->CAS DataBase List--->6082-66-2

6082-66-2

6082-66-2 Structure

6082-66-2 Structure
IdentificationBack Directory
[Name]

3,4,6-Trichloropyridazine
[CAS]

6082-66-2
[Synonyms]

3,4,6-TrichL
6-Trichloropyridazine
3,4,6-TRICHLOROPYRIDAZINE
3,4,6-Trichloro-1,2-diazine
Pyridazine, 3,4,6-trichloro-
3-METHYL-2-BENZOXAZOLINONE,PLANT STANDARD
3,4,6-Trichloropyridazine ISO 9001:2015 REACH
[EINECS(EC#)]

629-902-8
[Molecular Formula]

C4HCl3N2
[MDL Number]

MFCD00834957
[MOL File]

6082-66-2.mol
[Molecular Weight]

183.42
Chemical PropertiesBack Directory
[Melting point ]

55.0 to 59.0 °C
[Boiling point ]

98°C/43mmHg(lit.)
[density ]

1.641±0.06 g/cm3(Predicted)
[storage temp. ]

Sealed in dry,Room Temperature
[solubility ]

soluble in Methanol
[form ]

powder to crystal
[pka]

-2.72±0.10(Predicted)
[color ]

White to Light yellow to Light orange
[λmax]

305nm(EtOH)(lit.)
[InChI]

InChI=1S/C4HCl3N2/c5-2-1-3(6)8-9-4(2)7/h1H
[InChIKey]

LJDQXQOPXOLCHL-UHFFFAOYSA-N
[SMILES]

C1(Cl)=NN=C(Cl)C=C1Cl
Safety DataBack Directory
[HazardClass ]

IRRITANT
[HS Code ]

2933998090
Hazard InformationBack Directory
[Uses]

3,4,6-Trichloropyridazine was used to study chloropyridazine derivatives as human rhinovirus capsid-binding inhibitors.
[Synthesis]

3,6-Dichloropyridazine

141-30-0

3,4,6-Trichloropyridazine

6082-66-2

The general procedure for the synthesis of 3,4,6-trichloropyridazine from 3,6-dichloropyridazine is as follows: 44 g of 3,6-dichloropyridazine and 22 g of aluminum trichloride were mixed and heated to 140°C. The mixture was then heated to 140°C for 4 hours. At this temperature, 10.6 liters of chlorine gas were slowly passed over a period of 4 hours. Upon completion of the reaction, the reaction mixture was cooled and extracted with toluene. The extract was subsequently washed with 10% sodium chloride solution and finally the product was purified by distillation to collect a fraction with a boiling point of 127-129 °C. Finally 44.1 g of 3,4,6-trichloropyridazine was obtained.

[References]

[1] Patent: EP1900735, 2008, A1. Location in patent: Page/Page column 9
[2] Patent: US2010/305102, 2010, A1. Location in patent: Page/Page column 17
[3] Patent: US2012/28932, 2012, A1
[4] Patent: US2013/237527, 2013, A1. Location in patent: Paragraph 0236; 0237
Spectrum DetailBack Directory
[Spectrum Detail]

3,4,6-Trichloropyridazine(6082-66-2)1HNMR
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79-01-6 133-67-5 87-90-1 56038-13-2 76-03-9 10025-78-2 21892-80-8 59-49-4 141-30-0 67-66-3

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