1H-Benzo[D][1,2,3]triazole-5-carbaldehyde

Base Information

Chemical Name:1H-Benzo[D][1,2,3]triazole-5-carbaldehyde
CAS No.:70938-42-0
Molecular Formula:C7H5N3O
Molecular Weight:147.136
Hs Code.:
European Community (EC) Number:849-790-6
DSSTox Substance ID:DTXSID10469220
Nikkaji Number:J2.234.586I
Wikidata:Q82296838
Mol file:70938-42-0.mol

Synonyms:1H-BENZO[D][1,2,3]TRIAZOLE-5-CARBALDEHYDE;70938-42-0;2H-benzotriazole-5-carbaldehyde;1H-BENZOTRIAZOLE-5-CARBOXALDEHYDE;1H-1,2,3-BENZOTRIAZOLE-5-CARBALDEHYDE;6-formyl-1H-benzotriazole;SCHEMBL1419004;DTXSID10469220;GJBWJHRJXRTAIC-UHFFFAOYSA-N;AKOS006229119;AB48534;1H-benzo[d][1,2,3]triazole-6-carbaldehyde;EN300-69797;Z1079086434

Suppliers and Price of 1H-Benzo[D][1,2,3]triazole-5-carbaldehyde

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
1H-benzo[d][1,2,3]triazole-5-carbaldehyde
25mg
$ 155.00

Crysdot
1H-Benzo[d][1,2,3]triazole-5-carbaldehyde 97%
5g
$ 3820.00

Crysdot
1H-Benzo[d][1,2,3]triazole-5-carbaldehyde 97%
1g
$ 1240.00

American Custom Chemicals Corporation
1H-BENZO[D][1,2,3]TRIAZOLE-5-CARBALDEHYDE 95.00%
5MG
$ 502.13

Total 9 raw suppliers

Chemical Property of 1H-Benzo[D][1,2,3]triazole-5-carbaldehyde

Chemical Property:

Boiling Point:448.9±18.0 °C(Predicted)
PKA:7.51±0.40(Predicted)
PSA：58.64000
Density:1.471±0.06 g/cm3(Predicted)
LogP:0.77040
XLogP3:0.5
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:1
Exact Mass:147.043261791
Heavy Atom Count:11
Complexity:162

Purity/Quality:

97% ^*data from raw suppliers

1H-benzo[d][1,2,3]triazole-5-carbaldehyde ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC2=NNN=C2C=C1C=O

Technology Process of 1H-Benzo[D][1,2,3]triazole-5-carbaldehyde

There total 7 articles about 1H-Benzo[D][1,2,3]triazole-5-carbaldehyde 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: 90.0%

: 106429-67-8
(1H-benzo[d][1,2,3]triazol-5-yl)methanol

: 70938-42-0
1H-1,2,3-benzotriazole-5-carbaldehyde

Guidance literature:: With dipyridinium dichromate; In acetone; at 20 ℃; for 4h;
DOI:10.1080/00397910500214151

Reference yield: 60.0%

: 68-12-2,33513-42-7
N,N-dimethyl-formamide

: 6-bromo-1H-benzo[d][1,2,3]triazole

: 70938-42-0
1H-benzo[d][1,2,3]triazole-5-carbaldehyde

Guidance literature:: With triethylsilyl chloride; palladium diacetate; sodium carbonate; johnphos; at 70 ℃; for 4h; Inert atmosphere;

Reference yield:

: 23814-12-2
1h-benzotriazole-5-carboxylic acid

: 70938-42-0
1H-1,2,3-benzotriazole-5-carbaldehyde

Guidance literature:: Multi-step reaction with 2 steps

1: LiAlH₄ / tetrahydrofuran / 10 h / 20 °C

2: TPAP; 4 Angstroem molecular sieves; NMO / CH₂Cl₂ / 1 h

With lithium aluminium tetrahydride; N-methyl-2-indolinone; tetrapropylammonium perruthennate; 4 A molecular sieve; In tetrahydrofuran; dichloromethane;
DOI:10.1021/jm0502790