4-aMino-1-Methyl-4H-1,2,4-triazol-1-iuM nitrate
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4-aMino-1-Methyl-4H-1,2,4-triazol-1-iuM nitrate
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CAS No:
817177-66-5
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Formula:
C3H7N5O3
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Chemical Name:
4-aMino-1-Methyl-4H-1,2,4-triazol-1-iuM nitrate
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Synonyms:
4-Amino-1-methyl-4H-1,2,4-triazol-1-ium nitrate;1-methyl-4-amino-1,2,4-triazolium nitrate;1H-1,2,4-Triazolium, 4-amino-1-methyl-nitrate;SCHEMBL2834761;KS-00000LEY;MFCD28053750;AKOS025149616;AK340879;DS-12215;FT-0688567
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CAS No:
4-aMino-1-Methyl-4H-1,2,4-triazol-1-iuM nitrate Use and Manufacturing
To a preweighed Erlenmeyer flask, 1.1726 grams, 5.18 mmoles of 1-methyl-4-amino-1, 2, 4-triazolium iodide was dissolved in twenty mL of fresh methanol and stirred vigorously with a Teflon stir bar. Silver nitrate, 0.8805 grams, 5.18 mmoles, was dissolved with 15 ml of methanol along with 3 ml of acetonitrile in a separate flask. The silver nitrate solution was added slowly to the vigorously stirred solution containing the 1-methyl-4-amino-1, 2, 4-triazolium iodide. After the addition of the silver nitrate solution was completed the reaction mixture was allowed to stir for 45 minutes more, then was filtered through a celite plug into a preweighed flask. The celite plug was washed with three five ml aliquots of fresh methanol. The filtrate flask was evacuated to leave a viscous oil which was then redissolved in 15 ml of fresh methanol and layered with 15 ml of diethyl ether, and subsequently placed in a refrigerator at 4° C. After 24 hours the filtrate solution was decanted away from the precipitated viscous oil, which was washed with three 10 ml aliquots of fresh diethyl ether and vacuum dried to a constant weight, 0.7936 g, 4.92 mmoles of
Computed Properties
Molecular Weight:161.12
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:5
Exact Mass:161.05488910
Monoisotopic Mass:161.05488910
Topological Polar Surface Area:111
Heavy Atom Count:11
Complexity:82.7
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
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