Thiophosgene

Base Information

• Chemical Name: Thiophosgene
• CAS No.: 463-71-8
• Molecular Formula: CCl2 S
• Molecular Weight: 114.983
• Hs Code.: HOSGENE PRODUCT IDENTIFICATION
• European Community (EC) Number: 207-341-6
• UN Number: 2474
• UNII: 067FQP576P
• DSSTox Substance ID: DTXSID2060046
• Nikkaji Number: J5.882C
• Wikipedia: Thiophosgene
• Wikidata: Q421064
• Metabolomics Workbench ID: 54061
• Mol file: 463-71-8.mol

Synonyms:thiophosgene

Chemical Property of Thiophosgene

Chemical Property:

• Appearance/Colour: yellow liquid
• Vapor Pressure: 127mmHg at 25°C
• Melting Point: <25 °C
• Refractive Index: n20/D 1.548(lit.)
• Boiling Point: 70 - 75 C
• Flash Point: 62 ºC
• PSA: 32.09000
• Density: 1.508
• LogP: 1.74890
• Storage Temp.: 2-8°C
• Solubility.: Chloroform
• Water Solubility.: slow decomposition in cold, fast in hot water
• XLogP3: 2.4
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 1
• Rotatable Bond Count: 0
• Exact Mass: 113.9097766
• Heavy Atom Count: 4
• Complexity: 29
• Transport DOT Label: Poison Inhalation Hazard

Purity/Quality:

99% ^*data from raw suppliers

Thiophosgene ^*data from reagent suppliers

Safty Information:

• Hazard Codes: T
• Statements: 22-23-36/37/38
• Safety Statements: 7-9-36/37-45-7/9

MSDS Files:

SDS file from LookChem

Useful:

• Chemical Classes: Toxic Gases & Vapors -> Other Toxic Gases & Vapors
• Canonical SMILES: C(=S)(Cl)Cl
• Uses: Thiophosgene is a photo degradation product of the agricultural fungicide Folpet (F402000).

Technology Process of Thiophosgene

There total 36 articles about Thiophosgene 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:

carbon disulfide (75-15-0,12122-00-8) + chlorine (7782-50-5) → disulfur dichloride (10025-67-9) + tetrachloromethane (56-23-5) + thiophosgene (463-71-8)

Guidance literature:

In gas; passing through glowing tube of porcelaine;;

Reference yield:

tetrachloromethane (56-23-5) → disulfur dichloride (10025-67-9) + thiophosgene (463-71-8)

Guidance literature:

With sulfur; at 130°C;

Reference yield:

tribenzylamine (620-40-6) + chlorothio-trichloro-methane (594-42-3) → thiophosgene (463-71-8) + benzyl chloride (100-44-7)

Guidance literature:

at 100 ℃;

DOI:10.1039/jr9370001629

upstream raw materials:

tetrachloromethane

Bis(trichloromethyl)disulfane

methyl phosphite

chlorothio-trichloro-methane

Downstream raw materials:

n-Propyl isothiocyanate

trithiocarbonic acid bis-(2-chloro-phenyl ester)

(2,5-dichlorophenyl)isothiocyanate

3-bromo-4-methyl-phenyl isothiocyanate

Refernces

• 1、 Boehme,Schneider. "-". . p. 483,485, 486. Retrieved 1943.
• 2、 Tobon, Yeny A.,Romano, Rosana M.,Della Vedova, Carlos O.,Downs, Anthony J.. "Formation of new halogenothiocarbonylsulfenyl halides, XC(S)SY, through photochemical matrix reactions starting from CS2 and a dihalogen molecule XY (XY = Cl2, Br2, or BrCl)". . p. 4692 - 4703. Retrieved 2008/10/09.
• 3、 -. "Chelating agents for attaching metal ions to proteins". . . Retrieved 2008/06/13.