Chlorocarbonylsulfenyl chloride

Base Information

• Chemical Name: Chlorocarbonylsulfenyl chloride
• CAS No.: 2757-23-5
• Molecular Formula: CCl2OS
• Molecular Weight: 130.982
• Hs Code.: 29309090
• European Community (EC) Number: 220-415-2
• DSSTox Substance ID: DTXSID10181970
• Nikkaji Number: J208.247K
• Wikidata: Q83052622
• Mol file: 2757-23-5.mol

Synonyms:Chlorocarbonylsulfenyl chloride;2757-23-5;S-chloro chloromethanethioate;(Chlorothio)formyl chloride;Chloroformylsulfenyl chloride;Carbonochloridothioic acid, anhydrosulfide with thiohypochlorous acid (9CI);carbonochloridic hypochlorous thioanhydride;chloro(chlorosulfanyl)methanone;EINECS 220-415-2;Carbonochloridothioic acid, anhydrosulfide with thiohypochlorous acid;CCl2OS;Chlorothioformyl Chloride;C-Cl2-O-S;chlorcarbonyl-sulfenylchloride;chlorocarbonylsulfenyl choride;chorocarbonylsulfenyl chloride;chlorocarbonylsulphenylchloride;chlorocarbonyl sulfenylchloride;SCHEMBL190135;chlorocarbonylsulphenyl chloride;chlorocarbonyl sulfenyl chloride;Chloro(chlorosulfanyl)oxomethane;chloro(chlorosulphanyl)oxomethane;(Chlorothio)formic acid chloride;Chlorocarbonyl sulphenyl chloride;DTXSID10181970;Chloro(chlorosulfanyl)oxomethane #;BBL104170;Chlorocarbonylsulfenyl chloride, 96%;MFCD00000703;STL557984;AKOS006223921;BS-43796;FT-0623635;EN300-98056;D89346;A819123;J-016814;CARBONOCHLORIDOTHIOICACID, ANHYDROSULFIDE WITH THIOHYPOCHLOROUS ACID (9CI)

Chemical Property of Chlorocarbonylsulfenyl chloride

Chemical Property:

• Appearance/Colour: Yellow liquid, fuming in moist air
• Vapor Pressure: 40.7mmHg at 25°C
• Refractive Index: n20/D 1.517(lit.)
• Boiling Point: 98 °C at 760 mmHg
• Flash Point: 53.7 °C
• PSA: 42.37000
• Density: 1.66 g/cm³
• LogP: 2.23220
• Storage Temp.: 2-8°C
• Sensitive.: Moisture Sensitive
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 0
• Exact Mass: 129.9046912
• Heavy Atom Count: 5
• Complexity: 44.9

Purity/Quality:

98% ^*data from raw suppliers

Chlorocarbonyl sulphenyl chloride ^*data from reagent suppliers

Safty Information:

• Pictogram(s): C
• Hazard Codes: C
• Statements: 34-37
• Safety Statements: 26-36/37/39-45

MSDS Files:

SDS file from LookChem

Total 1 MSDS from other Authors

Useful:

• Canonical SMILES: C(=O)(SCl)Cl
• Uses: Chlorocarbonylsulfenyl chloride has been used in the preparation of:5-(1,2,3,4-tetra-O-acetyl-alpha-D-xylopyranos-5S-C-yl)-1,3,4-oxathiazol-2-onefluorinated oxathialonespolyfluoroalkylchlorothioformateschlorocarbonylpolyfluoroalkylsulfenate esterschlorocarbonylhexafluoroisopropylidenimino sulfenate5-tri-fluoromethyl-2-oxo-1,3,4-oxathiazolecommercially important N,N-dialkylcarbamoyl chlorides

Technology Process of Chlorocarbonylsulfenyl chloride

There total 6 articles about Chlorocarbonylsulfenyl chloride 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: 65.0%

chlorothio-trichloro-methane (594-42-3) → chloro(chlorosulfanyl)methanone (2757-23-5)

Guidance literature:

With sulfuric acid; In water; at 45 - 50 ℃; for 6h;

DOI:10.1021/jo00172a056

Reference yield:

carbon oxide sulfide (463-58-1) + chlorine (7782-50-5) → phosgene (75-44-5) + syn-ClC(O)SCl (2757-23-5) + chloroformyl radical (2602-42-8) + carbon monoxide (201230-82-2) + sulfur dichloride (10545-99-0)

Guidance literature:

In solid matrix; byproducts: OC*Cl2, syn-ClC(O)SSCl; Irradiation (UV/VIS); gas mixt. of Cl2, OCS, and Ar (Cl2/OCS/Ar = 1:2:200, 1:1:200, 2:1:200) prepared by manometric method; deposited on CsI window (15 K); irradiatedwith Hg-Xe arc lamp (200<=λ<=800 nm) up to 5 h; not isolated;

DOI:10.1021/jp056135e

Reference yield:

2,2,4,4-tetrachlor-1,3-dithietan-1,3-dioxids (85963-74-2) → phosgene (75-44-5) + carbon monoxide (201230-82-2) + (Dichlormethylen)sulfoxid (24768-49-8) + chloro(chlorosulfanyl)methanone (2757-23-5)

Guidance literature:

at 530 ℃; Product distribution; Irradiation; study of the structure of the products generated by flash vacuum pyrolysis of various 2,2,4,4-tetrahalogeno-1,3-dithietan;

DOI:10.1016/0584-8539(86)80227-6

upstream raw materials:

chlorothio-trichloro-methane

(methoxydichloromethyl)sulfenyl chloride

(ethoxydichloromethyl)sulfenyl chloride

2,2,4,4-tetrachlor-1,3-dithietan-1,3-dioxids

Downstream raw materials:

4-methyl-2-thiazolone-5-carboxylic acid ethyl ester

2-(2-oxo-1,3,4-oxathiazol-5-yl)benzonitrile

5-(2,4,6-Trimethylphenyl)-1,2,4-dithiazol-3-on

5-(2-Iodphenyl)-1,3,4-oxathiazol-2-on

Refernces

• 1、 Adeppa,Rupainwar,Misra, Krishna. "Improved method for the preparation of 1,1-dimethyl-3-arylureas using chlorocarbonylsulfenyl chloride". experimental part. p. 714 - 721. Retrieved 2012/01/13.
• 2、 Tobon, Yeny A.,Nieto, Laura I.,Romano, Rosana M.,Della Vedova, Carlos O.,Downs, Anthony J.. "Photochemical reaction channels of OCS with Cl2, ICI, or IBr isolated together in an argon matrix: Isolation of syn-iodocarbonylsulfenyl bromide". . p. 2674 - 2681. Retrieved 2008/10/09.