alpha-Phenyl-3-pyridazineethanethioamide

Base Information

Chemical Name:alpha-Phenyl-3-pyridazineethanethioamide
CAS No.:66978-41-4
Molecular Formula:C12H11N3S
Molecular Weight:229.305
Hs Code.:
DSSTox Substance ID:DTXSID80985785
Nikkaji Number:J395.004B

Synonyms:alpha-Phenyl-3-pyridazineethanethioamide;66978-41-4;M 76010;BRN 5523263;3-Pyridazineethanethioamide, alpha-phenyl-;2-phenyl-2-(3-pyridazinyl)thioacetamide;SCHEMBL11471475;DTXSID80985785;DJZUDOPYNCTQGI-UHFFFAOYSA-N;LS-129588;2-Phenyl-2-(pyridazin-3-yl)ethanimidothioic acid;M-76011

Suppliers and Price of alpha-Phenyl-3-pyridazineethanethioamide

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

Total 3 raw suppliers

Chemical Property of alpha-Phenyl-3-pyridazineethanethioamide

Chemical Property:

Vapor Pressure:9.72E-09mmHg at 25°C
Boiling Point:462.6°Cat760mmHg
Flash Point:233.6°C
PSA：88.43000
Density:1.265g/cm³
LogP:2.61530
XLogP3:1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:3
Rotatable Bond Count:3
Exact Mass:229.06736854
Heavy Atom Count:16
Complexity:238

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

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:C1=CC=C(C=C1)C(C2=NN=CC=C2)C(=S)N

Technology Process of alpha-Phenyl-3-pyridazineethanethioamide

There total 2 articles about alpha-Phenyl-3-pyridazineethanethioamide 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: 94.0%

: 66978-40-3
α-phenyl-α-(pyridazin-3-yl)-acetonitrile

: 66978-41-4
2-phenyl-2-(3-pyridazinyl)thioacetamide

Guidance literature:: With triethylamine; In pyridine; ethanol;

Reference yield:

: 140-29-4
phenylacetonitrile

: 66978-41-4
2-phenyl-2-(3-pyridazinyl)thioacetamide

Guidance literature:: Multi-step reaction with 2 steps

1: 65 percent / sodium amide / benzene / 1.) 6 h, room temperature, 2.) 4 h, reflux

2: 1.) triethylamine, 2.) hydrogen sulfide / 1.) pyridine, 30 min, room temperature, 2.) pyridine, 20 min, 0 deg C, 2 days, room temperature

With hydrogen sulfide; sodium amide; triethylamine; In benzene;
DOI:10.1248/cpb.29.3433