1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid

Base Information

Chemical Name:1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid
CAS No.:210159-10-7
Molecular Formula:C₁₀H₈BrN₃O₂
Molecular Weight:282.096
Hs Code.:
DSSTox Substance ID:DTXSID001177911
Nikkaji Number:J1.174.069C

Synonyms:1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid;210159-10-7;1-(2-bromophenyl)-5-methyltriazole-4-carboxylic acid;SCHEMBL3456998;VZRDZUITJRPGNL-UHFFFAOYSA-N;DTXSID001177911;HMS3435P17;MFCD10006796;AKOS002676735;CCG-127071;EN300-395292;F3382-6280;Z381397926;1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylicacid

Suppliers and Price of 1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid

Supply Marketing:

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

Manufacturers and distributors:

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Total 1 raw suppliers

Chemical Property of 1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid

Chemical Property:

XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:280.97999
Heavy Atom Count:16
Complexity:277

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC1=C(N=NN1C2=CC=CC=C2Br)C(=O)O

Technology Process of 1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid

There total 5 articles about 1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid 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: 80.0%

: 3302-39-4
1-azido-2-bromobenzene

: 141-97-9
ethyl acetoacetate

: 210159-10-7
1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid

Guidance literature:: With sodium ethanolate; In ethanol; at 80 ℃;
DOI:10.1021/acs.jmedchem.8b01408

Reference yield: 80.0%

: 210159-10-7
1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid

Guidance literature:: With hydrogenchloride; sodium nitrite; In water; at 0 ℃; for 1h;

With sodium azide; In water; at 0 ℃; for 1h;

With sodium ethanolate; In methanol; at 80 ℃;

Reference yield:

: 615-36-1
2-bromoaniline

: 210159-10-7
1-(2-bromophenyl)-5-methyl-1H-1,2,3-triazole-4-carboxylic acid

Guidance literature:: Multi-step reaction with 2 steps

1.1: sodium nitrite; hydrogenchloride / 0 - 5 °C

1.2: 0 - 5 °C

2.1: sodium ethanolate / ethanol

With hydrogenchloride; sodium ethanolate; sodium nitrite; In ethanol;
DOI:10.1039/c4ra14811h DOI:10.1016/j.molstruc.2022.132516