ethyl 1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxylate

Base Information

Chemical Name:ethyl 1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxylate
CAS No.:126800-25-7
Molecular Formula:C₁₃H₁₅N₃O₃
Molecular Weight:261.28
Hs Code.:
DSSTox Substance ID:DTXSID301166773

Synonyms:ethyl 1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxylate;126800-25-7;DTXSID301166773;AKOS040815272;F2157-1393

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

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Chemical Property of ethyl 1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxylate

Chemical Property:

XLogP3:1.8
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:261.11134135
Heavy Atom Count:19
Complexity:301

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:

Useful:

Canonical SMILES:CCOC(=O)C1=CN(N=N1)CC2=CC(=CC=C2)OC

Technology Process of ethyl 1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-carboxylate

There total 2 articles about ethyl 1-[(3-methoxyphenyl)methyl]-1H-1,2,3-triazole-4-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: 88.0%

: 123767-44-2
3-methoxylbenzyl azide

: 623-47-2
propynoic acid ethyl ester

: 126800-25-7
ethyl 1-(3-methoxybenzyl)-1H-1,2,3-triazole-4-carboxylate

Guidance literature:: In ethanol; for 20h; Heating;

Reference yield:

: 6971-51-3
3-methoxybenzyl alcohol

: 126800-25-7
ethyl 1-(3-methoxybenzyl)-1H-1,2,3-triazole-4-carboxylate

Guidance literature:: Multi-step reaction with 3 steps

1: phosphorus tribromide / dichloromethane / 1 h / 0 °C

2: sodium azide / dimethyl sulfoxide / 8 h / 20 °C

3: sodium L-ascorbate; copper(ll) sulfate pentahydrate / tert-butyl alcohol; water / 8 h / 20 °C

With sodium azide; copper(ll) sulfate pentahydrate; phosphorus tribromide; sodium L-ascorbate; In dichloromethane; water; dimethyl sulfoxide; tert-butyl alcohol;
DOI:10.1039/d0md00162g