Sulfallate

Base Information

• Chemical Name: Sulfallate
• CAS No.: 95-06-7
• Molecular Formula: C8H14 Cl N S2
• Molecular Weight: 223.791
• Hs Code.: 29302000
• European Community (EC) Number: 202-388-9
• NSC Number: 16085
• UN Number: 3082,2991
• UNII: 7U7BI7173J
• DSSTox Substance ID: DTXSID7021289
• Nikkaji Number: J4.707D
• Wikidata: Q27155815
• NCI Thesaurus Code: C44448
• ChEMBL ID: CHEMBL538146
• Mol file: 95-06-7.mol

Synonyms:2-chloroallyl diethyldithiocarbamate;CDEC;sulfallate;Vegadex

Chemical Property of Sulfallate

Chemical Property:

• Appearance/Colour: amber liquid
• Vapor Pressure: 0.00979mmHg at 25°C
• Melting Point: 25°C
• Refractive Index: nD25 1.5822
• Boiling Point: 264.3°Cat760mmHg
• PKA: 0.71±0.50(Predicted)
• Flash Point: 113.6°C
• PSA: 60.63000
• Density: 1.159g/cm³
• LogP: 3.09880
• Storage Temp.: APPROX 4°C
• Water Solubility.: 100 mg l-1
• XLogP3: 3.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 223.0256195
• Heavy Atom Count: 12
• Complexity: 166
• Transport DOT Label: Class 9

Purity/Quality:

95+% ^*data from raw suppliers

Sulfallate ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T,N
• Statements: 45-22-50/53
• Safety Statements: 53-45-60-61

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Chemical Classes: Pesticides -> Dithiocarbamates (Pesticide)
• Canonical SMILES: CCN(CC)C(=S)SCC(=C)Cl
• Uses: Sulfallate is a selective pre-planting or pre-emergence herbicide. Herbicide.

Technology Process of Sulfallate

There total 2 articles about Sulfallate 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:

2,3-Dichloroprop-1-ene (78-88-6) + sodium N,N-diethyldithiocarbamate (148-18-5) → sulfallate (95-06-7)

Guidance literature:

With water;

DOI:10.1021/ja01112a509

Reference yield:

→ sulfallate (95-06-7)

Guidance literature:

upstream raw materials:

2,3-Dichloroprop-1-ene

sodium N,N-diethyldithiocarbamate

Refernces