1,2,3-Triazolo(4,5-d)(2)benzazepine, 2,4-dihydro-8-chloro-6-(2-fluorophenyl)-

Base Information

Chemical Name:1,2,3-Triazolo(4,5-d)(2)benzazepine, 2,4-dihydro-8-chloro-6-(2-fluorophenyl)-
CAS No.:78131-53-0
Molecular Formula:C16H10ClFN4
Molecular Weight:312.7288
Hs Code.:
DSSTox Substance ID:DTXSID20228784
ChEMBL ID:CHEMBL340470

Synonyms:BRN 5982349;1,2,3-Triazolo(4,5-d)(2)benzazepine, 2,4-dihydro-8-chloro-6-(2-fluorophenyl)-;2,4-Dihydro-8-chloro-6-(2-fluorophenyl)-1,2,3-triazolo(4,5-d)(2)benzazepine;78131-53-0;C16H10ClFN4;CHEMBL340470;SCHEMBL11110795;C16-H10-Cl-F-N4;DTXSID20228784;LS-156275

Suppliers and Price of 1,2,3-Triazolo(4,5-d)(2)benzazepine, 2,4-dihydro-8-chloro-6-(2-fluorophenyl)-

Supply Marketing:

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

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Chemical Property of 1,2,3-Triazolo(4,5-d)(2)benzazepine, 2,4-dihydro-8-chloro-6-(2-fluorophenyl)-

Chemical Property:

Vapor Pressure:7.91E-11mmHg at 25°C
Boiling Point:531.1°C at 760 mmHg
Flash Point:275°C
Density:1.5g/cm³
XLogP3:3.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:1
Exact Mass:312.0578022
Heavy Atom Count:22
Complexity:446

Purity/Quality:

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1C2=NNN=C2C3=C(C=C(C=C3)Cl)C(=N1)C4=CC=CC=C4F

Technology Process of 1,2,3-Triazolo(4,5-d)(2)benzazepine, 2,4-dihydro-8-chloro-6-(2-fluorophenyl)-

There total 5 articles about 1,2,3-Triazolo(4,5-d)(2)benzazepine, 2,4-dihydro-8-chloro-6-(2-fluorophenyl)- 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%

: 83948-81-6
4-<4-chloro-2-(2-fuorobenzoyl)phenyl>-5--2H-1,2,3-triazole

: 78131-53-0
8-Chloro-6-(2-fluorophenyl)-2H,4H-[1,2,3]triazolo[4,5-d][2]benzazepine

Guidance literature:: With methylamine; In ethanol; for 12h; Ambient temperature;
DOI:10.1021/jm00357a011

Reference yield:

: 76049-53-1
1-[4-chloro-2-(2-fluorobenzoyl)phenyl]-3-phthalimidopropyne

: 78131-53-0
8-Chloro-6-(2-fluorophenyl)-2H,4H-[1,2,3]triazolo[4,5-d][2]benzazepine

Guidance literature:: Multi-step reaction with 2 steps

1: 26 percent / sodium azide, acetic acid / dimethylsulfoxide / 48 h / 50 °C

2: 88 percent / 40 percent aq. methylamine / ethanol / 12 h / Ambient temperature

With sodium azide; acetic acid; methylamine; In ethanol; dimethyl sulfoxide;
DOI:10.1021/jm00357a011

Reference yield:

: 78131-62-1
1-{4-chloro-2-[(2-fluorophenyl)hydroxymethyl]phenyl}-3-phthalimidopropyne

: 78131-53-0
8-Chloro-6-(2-fluorophenyl)-2H,4H-[1,2,3]triazolo[4,5-d][2]benzazepine

Guidance literature:: Multi-step reaction with 3 steps

1: 1.3 g / sodium azide, acetic acid / dimethylsulfoxide / 96 h / 90 °C

2: 60 percent / Jones reagent / acetone / 1 h / Ambient temperature

3: 88 percent / 40 percent aq. methylamine / ethanol / 12 h / Ambient temperature

With sodium azide; jones reagent; acetic acid; methylamine; In ethanol; dimethyl sulfoxide; acetone;
DOI:10.1021/jm00357a011