4-(2H-1,2,3-triazol-2-yl)benzaldehyde

Base Information

Chemical Name:4-(2H-1,2,3-triazol-2-yl)benzaldehyde
CAS No.:179056-04-3
Molecular Formula:C9H7N3O
Molecular Weight:173.174
Hs Code.:2933990090
DSSTox Substance ID:DTXSID40444964
Wikidata:Q72509748
Mol file:179056-04-3.mol

Synonyms:4-(2H-1,2,3-triazol-2-yl)benzaldehyde;179056-04-3;4-(triazol-2-yl)benzaldehyde;4-[1,2,3]Triazol-2-yl-benzaldehyde;4-[1,2,3]Triazol-2-ylbenzaldehyde;Benzaldehyde, 4-(2H-1,2,3-triazol-2-yl)-;SCHEMBL1609941;AMY1895;DTXSID40444964;CTYWOTWHICQOMA-UHFFFAOYSA-N;MFCD08669904;AKOS006290252;4-[1,2,3]-triazol-2-yl-benzaldehyde;DS-15895;CS-0043757;FT-0660314;P16392;A919324

Suppliers and Price of 4-(2H-1,2,3-triazol-2-yl)benzaldehyde

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

SynChem
4-[1,2,3]Triazol-2-yl-benzaldehyde 95%
10 g
$ 975.00

SynChem
4-[1,2,3]Triazol-2-yl-benzaldehyde 95%
5 g
$ 585.00

SynChem
4-[1,2,3]Triazol-2-yl-benzaldehyde 95%
1 g
$ 195.00

Crysdot
4-(2H-1,2,3-Triazol-2-yl)benzaldehyde 95+%
1g
$ 265.00

Chemenu
4-(2H-1,2,3-triazol-2-yl)benzaldehyde 95%
1g
$ 337.00

Ark Pharm
4-(2H-1,2,3-Triazol-2-yl)benzaldehyde 97%
1g
$ 244.00

Ark Pharm
4-(2H-1,2,3-Triazol-2-yl)benzaldehyde 97%
250mg
$ 98.00

Ark Pharm
4-(2H-1,2,3-Triazol-2-yl)benzaldehyde 97%
100mg
$ 61.00

American Custom Chemicals Corporation
4-(2H-1,2,3-TRIAZOL-2-YL)BENZALDEHYDE 95.00%
5MG
$ 496.57

Ambeed
4-(2H-1,2,3-Triazol-2-yl)benzaldehyde 97%
1g
$ 298.00

Total 14 raw suppliers

Chemical Property of 4-(2H-1,2,3-triazol-2-yl)benzaldehyde

Chemical Property:

Vapor Pressure:0mmHg at 25°C
Melting Point:100-102 °C
Refractive Index:1.643
Boiling Point:356.824 °C at 760 mmHg
PKA:-0.08±0.22(Predicted)
Flash Point:169.601 °C
PSA：47.78000
Density:1.256 g/cm³
LogP:1.07980
Storage Temp.:under inert gas (nitrogen or Argon) at 2-8°C
XLogP3:1.4
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:2
Exact Mass:173.058911855
Heavy Atom Count:13
Complexity:172

Purity/Quality:

97% ^*data from raw suppliers

4-[1,2,3]Triazol-2-yl-benzaldehyde 95% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC(=CC=C1C=O)N2N=CC=N2
Uses 4-(2H-1,2,3-Triazol-2-yl)benzaldehyde is useful in the synthesis of cholesterol O-acyltransferase inhibitors.

Technology Process of 4-(2H-1,2,3-triazol-2-yl)benzaldehyde

There total 2 articles about 4-(2H-1,2,3-triazol-2-yl)benzaldehyde 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: 79.0%

: 1122-91-4
4-bromo-benzaldehyde

: 288-36-8,288-35-7
1 ,2,3-Triazole

: 179056-04-3
4-(2H-1,2,3-triazol-2-yl)benzaldehyde

Guidance literature:: With 2-di-tertbutylphosphino-3,4,5,6-tetramethyl-2',4',6'-triisopropyl-1,1'-biphenyl; potassium phosphate; tris-(dibenzylideneacetone)dipalladium⁽⁰⁾; In toluene; at 120 ℃; for 5h; regioselective reaction; Inert atmosphere;
DOI:10.1002/anie.201103882

Reference yield: 49.0%

: 288-36-8
1,2,3-triazole

: 459-57-4
4-fluorobenzaldehyde

: 41498-10-6
4-(1H-1,2,3-triazol-1-yl)benzaldehyde

: 179056-04-3
4-(2H-1,2,3-triazol-2-yl)benzaldehyde

Guidance literature:: With potassium carbonate; In N,N-dimethyl-formamide; at 120 ℃; for 1h;
DOI:10.1021/jm9800853

Reference yield: 88.0%

: 67-56-1
methanol

: 75-25-2
Bromoform

: 179056-04-3
4-(2H-1,2,3-triazol-2-yl)benzaldehyde

: 1333472-81-3
2-(4-(2H-1,2,3-triazol-2-yl)phenyl)-2-methoxyacetic acid

Guidance literature:: methanol; Bromoform; 4-(2H-1,2,3-triazol-2-yl)benzaldehyde; With potassium hydroxide; at 20 ℃; Cooling;

With hydrogenchloride; In water; pH=1;