2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate

C20H38O4S2

CAS62268-47-7
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
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Identification

CAS Number
62268-47-7
EC Number
404-510-8
UN Number
3082
Index Number
607-219-00-6
PubChem CID
2762541

Physical-chemical properties

Molecular Formula
C20H38O4S2
Molar Mass
406.60 g/mol
IUPAC Name
2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate

Chemical Identifiers

InChI
InChI=1S/C20H38O4S2/c1-5-9-11-17(7-3)13-23-19(21)15-25-26-16-20(22)24-14-18(8-4)12-10-6-2/h17-18H,5-16H2,1-4H3
InChI Key
YREDCFUZMPDCSM-UHFFFAOYSA-N

Overview

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate (CAS 62268-47-7) is an organosulfur compound with disulfide linkage and ester functionalities. This specialized chemical compound belongs to the family of disulfide-containing esters, characterized by its unique molecular structure featuring two 2-ethylhexyl groups connected through a central disulfide bridge. With the molecular formula C20H38O4S2 and a molecular weight of 406.6 g/mol, this substance represents an important intermediate in various industrial chemical processes. The compound's structure incorporates both hydrophilic and lipophilic properties due to its dual ester groups and branched alkyl chains, making it particularly valuable in applications requiring specific solubility characteristics. From a safety perspective, this compound is classified under multiple hazard categories including Acute Toxicity Category 4, Skin Sensitization Category 1, and Aquatic Chronic Toxicity Category 2. The GHS07 and GHS09 pictograms indicate both health hazards and environmental concerns, requiring appropriate handling protocols and personal protective equipment during industrial use. Its ADR Class 9 classification designates it as a miscellaneous dangerous substance for transportation purposes, necessitating specialized shipping and storage procedures. The disulfide functionality in this compound makes it particularly relevant in applications where controlled oxidation-reduction chemistry is required, similar to how other organosulfur compounds like S-benzyl N,N-dipropylcarbamothioate are utilized in agricultural formulations. Industrial applications typically include use as a chemical intermediate in polymer synthesis, as a crosslinking agent in specialized coatings, and in the production of rubber additives where disulfide bonds provide enhanced mechanical properties. OYSI maintains reliable supply chains for this technical-grade compound, ensuring consistent availability for European industrial customers requiring this specialized organosulfur chemistry.

Safety & Classification

Warning
Classification:

Acute Tox. 4 *; Skin Sens. 1; Aquatic Chronic 2

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H302

Harmful if swallowed.

H317

May cause an allergic skin reaction.

H411

Toxic to aquatic life with long lasting effects.

Classification according to CLP Regulation (EC) No 1272/2008. The complete list of hazard and precautionary statements can be found in the Safety Data Sheet (SDS).

First Aid Measures

Skin Contact

Irritant

Measures if substance contacts the skin

First Aid Actions

  • +P302IF ON SKIN:
  • +P352Wash with plenty of water.
  • +P361Take off immediately all contaminated clothing.
  • +P313Get medical advice/attention.

Related hazard statements:

Ingestion

Harmful

Measures if substance is accidentally swallowed

First Aid Actions

  • +P301IF SWALLOWED:
  • +P330Rinse mouth.
  • +P331Do NOT induce vomiting.
  • +P310Immediately call a POISON CENTER/doctor.

Related hazard statements:

General Measures

Emergency 112 | Poison Control: +49 30 19240 (DE), +33 1 45 42 59 59 (FR), +31 30 274 88 88 (NL)

First aid measures are based on CLP classification and associated P-statements. They do not replace the Safety Data Sheet (SDS). In case of emergency, always consult the full SDS and a physician.

Transport (ADR)

UN Number3082
ADR Class9
Packing GroupIII
Tunnel Code-
Proper Shipping NameBis(2-ethylhexyl)dithiodiacetat
Marine PollutantNo

Frequently Asked Questions

What is 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate?

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate is an organic disulfide compound with the molecular formula C20H38O4S2 and CAS number 62268-47-7. This chemical features two ethylhexyl ester groups connected by a disulfide bridge, giving it a molecular weight of 406.6 g/mol. It is classified as a hazardous substance with acute toxicity, skin sensitization properties, and chronic aquatic toxicity concerns.

What are the physicochemical properties of 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate?

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate is a liquid organic compound with a molecular weight of 406.6 g/mol. Due to its long aliphatic chains and ester functionalities, it likely exhibits low water solubility but good solubility in organic solvents. The presence of the disulfide bond may contribute to a characteristic sulfur-like odor. Its high molecular weight suggests relatively low volatility at room temperature.

What is 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate used for?

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate is primarily used as an additive in industrial applications. Its disulfide structure makes it valuable as an antioxidant or stabilizer in polymer formulations, particularly in rubber and plastic industries. The compound may also serve as an intermediate in chemical synthesis or as a specialty chemical in formulations requiring disulfide functionality for crosslinking or protective properties.

How to handle 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate safely?

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate requires careful handling due to its acute toxicity and skin sensitization properties. Operators must wear appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing. Work should be conducted in well-ventilated areas or under local exhaust ventilation. Avoid skin and eye contact, inhalation, and ingestion. Wash hands thoroughly after handling and before eating or drinking.

How to store 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate correctly?

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate should be stored in tightly sealed containers in a cool, dry, and well-ventilated area away from heat sources and direct sunlight. Keep containers upright and protected from physical damage. Store separately from incompatible materials such as strong oxidizers, acids, and bases. Ensure storage areas comply with local fire and safety regulations, and maintain proper inventory control with clear labeling.

What to do in case of contact with 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate?

In case of skin contact with 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. For eye contact, rinse immediately with clean water for 15 minutes while holding eyelids open. If inhaled, move to fresh air immediately. If ingested, do not induce vomiting and seek immediate medical attention. Contact emergency services if symptoms persist or worsen.

How to dispose of 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate appropriately?

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate must be disposed of as hazardous waste according to local and national regulations. Contact licensed waste disposal companies specialized in chemical waste treatment. Do not discharge into sewers, waterways, or soil due to its aquatic toxicity classification. Small quantities may require incineration at authorized facilities equipped for hazardous organic compounds. Always consult local environmental authorities for specific disposal requirements.

How to transport 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate?

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate is classified as ADR Class 9 (Miscellaneous dangerous substances), Packing Group III. Transportation requires appropriate UN-approved packaging and proper hazard labeling including GHS07 and GHS09 pictograms. Shipping documents must include the correct technical name, UN number, and hazard class. Vehicles must carry appropriate emergency equipment, and drivers require ADR certification for Class 9 dangerous goods.

Is 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate subject to specific regulations?

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate is subject to European REACH regulation for chemical registration and CLP regulation for classification and labeling. It carries hazard classifications for acute toxicity (Cat. 4), skin sensitization (Cat. 1), and chronic aquatic toxicity (Cat. 2). The substance is not currently listed as SVHC (Substance of Very High Concern). Users must comply with safety data sheet requirements and workplace exposure limits where applicable.

Where to buy 2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate in Europe?

2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides this compound to industrial customers across Europe with proper documentation including safety data sheets and certificates of analysis. As a professional chemical distributor, OYSI ensures compliance with European regulations and provides technical support for industrial applications. Contact OYSI directly for availability, specifications, and regulatory documentation.

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2-ethylhexyl 2-[[2-(2-ethylhexoxy)-2-oxoethyl]disulfanyl]acetate is a dangerous good. We support you with labeling, packaging, and transport documentation.

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Data Sources

Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.