S-(1,2-diformylpyrazolidin-4-yl) ethanethioate

Base Information

Chemical Name:S-(1,2-diformylpyrazolidin-4-yl) ethanethioate
CAS No.:216854-55-6
Molecular Formula:C₇H₁₀N₂O₃S
Molecular Weight:202.234
Hs Code.:
DSSTox Substance ID:DTXSID40444000
Nikkaji Number:J1.063.217J
Wikidata:Q72471180
Mol file:216854-55-6.mol

Synonyms:216854-55-6;S-(1,2-diformylpyrazolidin-4-yl) ethanethioate;4-(Acetylthio)-1,2-diformylpyrazolidine;4-(ACETYLTHIO)-1,2-DIFORMYL PYRAZOLIDINE;DTXSID40444000;AKOS015898467;FT-0693915;4-(Acetylthio)-1,2-pyrazolidinedicarbaldehyde;S-1,2-diformylpyrazolidin-4-yl ethanethioate;4-ACETYLTHIO-1,2-DIFORMYL PYRAZOLIDINE;S-(1,2-diformylpyrazolidin-4-yl)ethanethioate;4-(acetylsulfanyl)pyrazolidine-1,2-dicarbaldehyde;3-AMINO-3-(3,4-DIFLUORO-PHENYL)-PROPIONICACID

Suppliers and Price of S-(1,2-diformylpyrazolidin-4-yl) ethanethioate

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

American Custom Chemicals Corporation
4-ACETYLTHIO-1,2-DIFORMYL PYRAZOLIDINE 98.00%
10G
$ 2442.83

AHH
4-(Acetylthio)-1,2-diformylpyrazolidine 98%
10g
$ 740.00

Total 13 raw suppliers

Chemical Property of S-(1,2-diformylpyrazolidin-4-yl) ethanethioate

Chemical Property:

Melting Point:47℃
PSA：82.99000
Density:1.39
LogP:0.62770
XLogP3:-0.3
Hydrogen Bond Donor Count:0
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:202.04121336
Heavy Atom Count:13
Complexity:218

Purity/Quality:

98%min ^*data from raw suppliers

4-ACETYLTHIO-1,2-DIFORMYL PYRAZOLIDINE 98.00% ^*data from reagent suppliers

Safty Information:

Pictogram(s):
Hazard Codes:

MSDS Files:: SDS file from LookChem

Useful:

Canonical SMILES:CC(=O)SC1CN(N(C1)C=O)C=O

Technology Process of S-(1,2-diformylpyrazolidin-4-yl) ethanethioate

There total 3 articles about S-(1,2-diformylpyrazolidin-4-yl) ethanethioate 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: 95.0%

: 162887-23-2
4-bromo-1,2-diformylpyrazolidine

: 10387-40-3
potassium thioacetate

: 216854-55-6
4-(acetylthio)-1,2-diformylpyrazolidine

Guidance literature:: In ethyl acetate; at 40 ℃; for 6h;
DOI:10.1021/jo980462j

Reference yield:

: 216854-53-4
1-allyl-1,2-diformylhydrazine

: 216854-55-6
4-(acetylthio)-1,2-diformylpyrazolidine

Guidance literature:: Multi-step reaction with 3 steps

1: 95 percent / LiBr*H₂O; Br₂ / CH₂Cl₂; methanol / 0.17 h / 0 °C

2: 74 percent / K₂CO₃ / ethyl acetate / 6 h / 40 °C

3: 95 percent / ethyl acetate / 6 h / 40 °C

With bromine; potassium carbonate; lithium bromide; In methanol; dichloromethane; ethyl acetate; 1: Bromination / 2: Cyclization / 3: Substitution;
DOI:10.1021/jo980462j

Reference yield:

: 216854-54-5
1-(2,3-dibromopropyl)-1,2-diformylhydrazine

: 216854-55-6
4-(acetylthio)-1,2-diformylpyrazolidine

Guidance literature:: Multi-step reaction with 2 steps

1: 74 percent / K₂CO₃ / ethyl acetate / 6 h / 40 °C

2: 95 percent / ethyl acetate / 6 h / 40 °C

With potassium carbonate; In ethyl acetate; 1: Cyclization / 2: Substitution;
DOI:10.1021/jo980462j