3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine
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3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine
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CAS No:
30169-25-6
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Formula:
C12H14N8
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Chemical Name:
3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine
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Synonyms:
3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine;3,6-Bis(2,4-DiMethyl-1H-pyrrol-1-yl)-1,2,4,5-tetrazine;3,6-BIS(3,5-DIMETHYL-1H-PYRAZOL-1-YL)-1,2,4,5-TETRAAZIN;bis(3,5-diMethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine;3,6-bis(2,4-dimethylpyrrol-1-yl)-1,2,4,5-tetrazine
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CAS No:
3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine Basic Attributes
270.29316
268.14400
2933990090
Safety Information
|Warning|H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]|P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 38 companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine Use and Manufacturing
Dissolve 26.2 g of sodium nitrite in 588 ml of water, 60 ml of dichloromethane are added, Cooled to 0 ° C, Then (37 g, 0.136 mol) of compound 2 was added, Acetic acid (18.67 ml, 0.326 mol) was added dropwise. When gas evolution ceased, methylene chloride was extracted and the organic phase was washed with potassium carbonate solution, After drying over magnesium sulfate, the organic solvent was spun off and recrystallized from ether to give compound 3 (33.45 g, 91percent).
Computed Properties
Molecular Weight:270.29
XLogP3:0.8
Hydrogen Bond Acceptor Count:6
Rotatable Bond Count:2
Exact Mass:270.13414248
Monoisotopic Mass:270.13414248
Topological Polar Surface Area:87.2
Heavy Atom Count:20
Complexity:299
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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3,6-Bis(3,5-dimethyl-1H-pyrazol-1-yl)-1,2,4,5-tetrazine
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