Disulfide, bis(2-chloroethyl)

Base Information

• Chemical Name: Disulfide, bis(2-chloroethyl)
• CAS No.: 1002-41-1
• Molecular Formula: C4H8 Cl2 S2
• Molecular Weight: 191.146
• Hs Code.: 2930909090
• European Community (EC) Number: 815-981-8
• NSC Number: 10976
• UNII: WJ3GQ42HNY
• DSSTox Substance ID: DTXSID40143006
• Nikkaji Number: J366.930K
• Wikidata: Q83006647
• Mol file: 1002-41-1.mol

Synonyms:Disulfide, bis(2-chloroethyl);1002-41-1;Bis(2-chloroethyl) disulfide;1-chloro-2-(2-chloroethyldisulfanyl)ethane;1,2-Bis(2-chloroethyl)disulfane;WJ3GQ42HNY;bis(2-chloroethyl)disulfide;1,6-Dichloro-3,4-dithiahexane;BIS(2-CHLOROETHYL)DISULPHIDE;NSC-10976;1-Chloro-2-[(2-chloroethyl)disulfanyl]ethane;Mustard disulfide;NSC10976;NSC 10976;UNII-WJ3GQ42HNY;2,2'-Dichloroethyl disulfide;SCHEMBL8762539;DTXSID40143006;AT21151;BS-44914;1-chloranyl-2-(2-chloroethyldisulfanyl)ethane;1-chloro-2-(2-chloro-ethyldisulfanyl)-ethane;1-Chloro-2-[(2-chloroethyl)disulfanyl]ethane #;EN300-1166934;A800255

Chemical Property of Disulfide, bis(2-chloroethyl)

Chemical Property:

• Vapor Pressure: 0.0364mmHg at 25°C
• Boiling Point: 249.4°Cat760mmHg
• Flash Point: 103.9°C
• PSA: 50.60000
• Density: 1.315g/cm³
• LogP: 2.84540
• XLogP3: 2.1
• Hydrogen Bond Donor Count: 0
• Hydrogen Bond Acceptor Count: 2
• Rotatable Bond Count: 5
• Exact Mass: 189.9444480
• Heavy Atom Count: 8
• Complexity: 37

Purity/Quality:

98%,99%, ^*data from raw suppliers

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C(CCl)SSCCCl

Technology Process of Disulfide, bis(2-chloroethyl)

There total 6 articles about Disulfide, bis(2-chloroethyl) 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:

bis (2-chloroethyl) sulphide (505-60-2) → chloroethylene (75-01-4,9002-86-2) + bis(2-chloroethyl)disulfide (1002-41-1) + acetaldehyde (75-07-0,9002-91-9)

Guidance literature:

With silica gel; titanium(IV) oxide; Reagent/catalyst; Kinetics; UV-irradiation;

DOI:10.1039/b810200g

Reference yield:

bis (2-chloroethyl) sulphide (505-60-2) → β-chloroethyl vinyl sulfide (81142-02-1) + bis(2-chloroethyl)disulfide (1002-41-1) + 1-(2-Chloroethylsulfinyl)ethene (40709-82-8) + carbon dioxide (124-38-9,18923-20-1) + acetaldehyde (75-07-0,9002-91-9)

Guidance literature:

With V_0.001Ti₀₉₉₉O₂; Reagent/catalyst; Catalytic behavior; Irradiation;

DOI:10.1016/j.molcata.2014.02.022

Reference yield:

→ bis(2-chloroethyl)disulfide (1002-41-1) + bis(2-chloroethyl) trisulfide (19149-77-0)

Guidance literature:

With acetone;

upstream raw materials:

2-chloroethyl sulfenyl chloride

ethene

bis (2-chloroethyl) sulphide

Downstream raw materials:

Bis-(2-phenoxyethyl) disulphide

1,2,5-trithiacycloheptane

divinyl disulfide

2-chloroethanesulphonic acid

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