ethyl 1-methyl-1H-1,2,4-triazole-5-carboxylate

Base Information

Chemical Name:ethyl 1-methyl-1H-1,2,4-triazole-5-carboxylate
CAS No.:106535-31-3
Molecular Formula:C₆H₉N₃O₂
Molecular Weight:155.156
Hs Code.:
European Community (EC) Number:854-238-2

Synonyms:ethyl 1-methyl-1H-1,2,4-triazole-5-carboxylate;106535-31-3;ethyl 2-methyl-1,2,4-triazole-3-carboxylate;ethyl1-methyl-1h-1,2,4-triazole-5-carboxylate;SCHEMBL752509;AKOS012660854;EN300-298682;ethyl 1-methyl-1 H -1,2,4-triazole-5-carboxylate;Z1124756571

Suppliers and Price of ethyl 1-methyl-1H-1,2,4-triazole-5-carboxylate

Supply Marketing:

Business phase:: The product has achieved commercial mass production^*data from LookChem market partment

Manufacturers and distributors:

Manufacture/Brand
Chemicals and raw materials
Packaging
price

TRC
Ethyl1-Methyl-1H-1,2,4-triazole-5-carboxylate
10mg
$ 65.00

AK Scientific
Ethyl1-methyl-1H-1,2,4-triazole-5-carboxylate
2.5g
$ 1190.00

AK Scientific
Ethyl1-methyl-1H-1,2,4-triazole-5-carboxylate
100mg
$ 293.00

Total 2 raw suppliers

Chemical Property of ethyl 1-methyl-1H-1,2,4-triazole-5-carboxylate

Chemical Property:

XLogP3:0.6
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:3
Exact Mass:155.069476538
Heavy Atom Count:11
Complexity:151

Purity/Quality:

98% ^*data from raw suppliers

Ethyl1-Methyl-1H-1,2,4-triazole-5-carboxylate ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C1=NC=NN1C

Technology Process of ethyl 1-methyl-1H-1,2,4-triazole-5-carboxylate

There total 2 articles about ethyl 1-methyl-1H-1,2,4-triazole-5-carboxylate which guide to synthetic route it. The literature collected by LookChem mainly comes from the sharing of users and the free literature resources found by Internet computing technology. We keep the original model of the professional version of literature to make it easier and faster for users to retrieve and use. At the same time, we analyze and calculate the most feasible synthesis route with the highest yield for your reference as below:

synthetic route:

Reference yield: 35.0%

: 64922-04-9
1H-1,2,4-triazole-3-carboxylic acid ethyl ester

: 74-88-4
methyl iodide

: 106535-31-3
2-methyl-2H-[1,2,4]triazole-3-carboxylic acid ethyl ester

: ethyl 1-methyl-1H-1,2,4-triazole-3-carboxylate

Guidance literature:: 1H-1,2,4-triazole-3-carboxylic acid ethyl ester; With potassium carbonate; In N,N-dimethyl-formamide; at 20 ℃; for 0.25h;

iodomethane; In N,N-dimethyl-formamide; at 20 ℃;
DOI:10.1007/s10593-022-03064-z

Reference yield:

: 69982-16-7
oxalic acid ethyl ester formamidrazone

: 106535-31-3
2-methyl-2H-[1,2,4]triazole-3-carboxylic acid ethyl ester

: ethyl 1-methyl-1H-1,2,4-triazole-3-carboxylate

Guidance literature:: Multi-step reaction with 2 steps

1.1: neat (no solvent) / 0.03 h / 150 °C

2.1: potassium carbonate / N,N-dimethyl-formamide / 0.25 h / 20 °C

2.2: 20 °C

With potassium carbonate; In N,N-dimethyl-formamide;
DOI:10.1007/s10593-022-03064-z

Reference yield: 86.0%

: 106535-31-3
2-methyl-2H-[1,2,4]triazole-3-carboxylic acid ethyl ester

: 500370-61-6
6-(4'-fluorobenzyloxy)-2-hydroxyacetophenone

: 500370-62-7
5-[(4 fluorobenzyl)oxy]-2-(2-methyl-2H-[1,2,4]triazole-3-yl)-4H-1-benzopyrane-4-one

Guidance literature:: 2-methyl-2H-[1,2,4]triazole-3-carboxylic acid ethyl ester; 6-(4'-fluorobenzyloxy)-2-hydroxyacetophenone; With potassium tert-butylate; In N,N-dimethyl-formamide; at 0 - 20 ℃; for 0.333333h;

With hydrogenchloride; In DMF (N,N-dimethyl-formamide); water; at 0 ℃;

With hydrogenchloride; sodium hydroxide; more than 3 stages;