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CAS No.: | 29334-67-6 |
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Name: | 3-CHLORO-6-(3,5-DIMETHYL-1H-PYRAZOL-1-YL)PYRIDAZINE |
Article Data: | 9 |
Molecular Structure: | |
Formula: | C9H9ClN4 |
Molecular Weight: | 208.65 |
Synonyms: | Pyridazine,3-chloro-6-(3,5-dimethylpyrazol-1-yl)- (7CI,8CI);3-(3,5-Dimethylpyrazol-1-yl)-6-chloropyridazine;3-Chloro-6-(3,5-dimethylpyrazol-1-yl)pyridazine;NSC 270405; |
Density: | 1.36 g/cm3 |
Melting Point: | 112-114 °C |
Boiling Point: | 380.2 °C at 760 mmHg |
Flash Point: | 183.7 °C |
Hazard Symbols: | Xi |
Risk Codes: | 22 |
PSA: | 43.60000 |
LogP: | 1.93250 |
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The Pyridazine,3-chloro-6-(3,5-dimethyl-1H-pyrazol-1-yl)-, with the CAS registry number 29334-67-6, is also known as 3-Chloro-6-(3,5-dimethyl-pyrazol-1-yl)-pyridazine. It belongs to the product categories of Blocks; Imidazoles; Pyridines. This chemical's molecular formula is C9H9ClN4 and molecular weight is 208.64756. Its IUPAC name is called 3-chloro-6-(3,5-dimethylpyrazol-1-yl)pyridazine. When you are using this chemical, please be cautious about it. This chemical may cause inflammation to the skin or other mucous membranes.
Physical properties of Pyridazine,3-chloro-6-(3,5-dimethyl-1H-pyrazol-1-yl)-: (1)ACD/LogP: 0.92; (2)#H bond acceptors: 4; (3)#Freely Rotating Bonds: 1; (4)Index of Refraction: 1.657; (5)Molar Refractivity: 56.27 cm3; (6)Molar Volume: 152.9 cm3; (7)Surface Tension: 46.5 dyne/cm; (8)Density: 1.36 g/cm3; (9)Flash Point: 183.7 °C; (10)Enthalpy of Vaporization: 60.37 kJ/mol; (11)Boiling Point: 380.2 °C at 760 mmHg; (12)Vapour Pressure: 1.21E-05 mmHg at 25°C.
Preparation: this chemical can be prepared by 3,6-dichloro-pyridazine and 3,5-dimethyl-1H-pyrazole. This reaction will need reagent K and solvent tetrahydrofuran. The yield is about 69%.
Uses of Pyridazine,3-chloro-6-(3,5-dimethyl-1H-pyrazol-1-yl)-: it can be used to produce 6-(3,5-dimethyl-pyrazol-1-yl)-2H-pyridazin-3-one by heating. This reaction will need reagent aq. NaOH with reaction time of 2 hours. The yield is about 60%.
You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=CC(=NN1C2=NN=C(C=C2)Cl)C
(2)InChI: InChI=1S/C9H9ClN4/c1-6-5-7(2)14(13-6)9-4-3-8(10)11-12-9/h3-5H,1-2H3
(3)InChIKey: OVXSFTFBSBIDMM-UHFFFAOYSA-N