1-METHYL-1,2,4-TRIAZOLE
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1-METHYL-1,2,4-TRIAZOLE
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CAS No:
6086-21-1
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Formula:
C3H5N3
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Chemical Name:
1-METHYL-1,2,4-TRIAZOLE
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Synonyms:
1-Methyltriazole;1-METHYL-1,2,4-TRIAZOLE;1-METHYL-1H-1,2,4-TRIAZOLE;1H-1,2,4-Triazole, 1-methyl-;1-Methyl-1,2,4-triazole, 99%, 99%
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CAS No:
Safety Information
R36/37/38
S26-S36/37/39
Xi: Irritant;F: Flammable;
P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, P501
H315
|Warning|H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]|P261, P264, P271, P280, P302+P352, P304+P340, P305+P351+P338, P312, P321, P332+P313, P337+P313, P362, P403+P233, P405, and P501|Aggregated GHS information provided by 6 companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
1-METHYL-1,2,4-TRIAZOLE Use and Manufacturing
50 mmol of sodium methoxide was added to a mixture of 50 mmol of 1, 2, 4-triazole (a compound of the formula II) and 50 ml of a methanol solution, and the resulting suspension was stirred at 25 ° C for 30 min. Thereafter, 60 mmol of methyl bromide was added dropwise, and the mixture was refluxed at 70 ° C for 12 h. The volatiles in the reaction mixture were removed in vacuo, washed with chloroform, and solid impurities were filtered, after, rotary evaporation removal and the washing solvent, a colorless liquid of 1-methyl-1, 2, 4-triazole 3.90 g was obtained.
1-METHYL-1,2,4-TRIAZOLE is an azole compound used for binding affinity with various cytochrome P 450 (CYP) proteins
Computed Properties
Molecular Weight:83.09
Hydrogen Bond Acceptor Count:2
Exact Mass:83.048347172
Monoisotopic Mass:83.048347172
Topological Polar Surface Area:30.7
Heavy Atom Count:6
Complexity:45.3
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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