Acetic acid, ((5-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazol-3-yl)thio)-

Base Information

Chemical Name:Acetic acid, ((5-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazol-3-yl)thio)-
CAS No.:77803-56-6
Molecular Formula:C₁₁H₉N₃O₄S
Molecular Weight:279.276
Hs Code.:
DSSTox Substance ID:DTXSID10228430
Wikidata:Q83108423

Synonyms:BRN 5348455;77803-56-6;Acetic acid, ((5-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazol-3-yl)thio)-;5-(3,4-Diossimetilenefenil)-3-carbossimetiltio-4H-(1,2,4-triazolo) [Italian];5-(3,4-Diossimetilenefenil)-3-carbossimetiltio-4H-(1,2,4-triazolo);DTXSID10228430;AKOS005924936

Suppliers and Price of Acetic acid, ((5-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazol-3-yl)thio)-

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
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Total 1 raw suppliers

Chemical Property of Acetic acid, ((5-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazol-3-yl)thio)-

Chemical Property:

Vapor Pressure:2.38E-14mmHg at 25°C
Boiling Point:581.2°Cat760mmHg
Flash Point:305.3°C
Density:1.68g/cm³
XLogP3:1.9
Hydrogen Bond Donor Count:2
Hydrogen Bond Acceptor Count:7
Rotatable Bond Count:4
Exact Mass:279.03137695
Heavy Atom Count:19
Complexity:346

Purity/Quality:: 99% ^*data from raw suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1OC2=C(O1)C=C(C=C2)C3=NC(=NN3)SCC(=O)O

Technology Process of Acetic acid, ((5-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazol-3-yl)thio)-

There total 4 articles about Acetic acid, ((5-(1,3-benzodioxol-5-yl)-1H-1,2,4-triazol-3-yl)thio)- 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%

: 77803-43-1
3-(3,4-diossimetilenefenil)-5-mercapto-4H-1,2,4-triazolo

: 79-11-8
chloroacetic acid

: 77803-56-6
5-(3,4-diossimetilenefenil)-3-carbossimetiltio-4H-1,2,4-triazolo

Guidance literature:: With sodium hydroxide; sodium hydrogencarbonate; Heating;

Reference yield:

: 22026-39-7
benzo[d][1,3]dioxole-5-carbohydrazide

: 77803-56-6
5-(3,4-diossimetilenefenil)-3-carbossimetiltio-4H-1,2,4-triazolo

Guidance literature:: Multi-step reaction with 3 steps

1: 85 percent / 1 h / Heating

2: 85 percent / 5percent NaOH / H₂O / 4 h / Heating

3: 80 percent / 1/10 N NaOH / H₂O / 2 h / Heating

With sodium hydroxide; In water;

Reference yield:

: 52190-69-9
C₉H₉N₃O₃S

: 77803-56-6
5-(3,4-diossimetilenefenil)-3-carbossimetiltio-4H-1,2,4-triazolo

Guidance literature:: Multi-step reaction with 2 steps

1: 85 percent / 5percent NaOH / H₂O / 4 h / Heating

2: 80 percent / 1/10 N NaOH / H₂O / 2 h / Heating

With sodium hydroxide; In water;