2-hexadecan-2-yl-4,6-dimethylphenol

C24H42O

CAS134701-20-5
GHS07 Gefahrensymbol: Gesundheitsschädlich/Reizend – Ausrufezeichen
GHS09 Gefahrensymbol: Umweltgefährlich – Umwelt
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Identification

CAS Number
134701-20-5
EC Number
411-220-5
UN Number
3082
Index Number
604-062-00-5
PubChem CID
164362

Physical-chemical properties

Molecular Formula
C24H42O
Molar Mass
346.60 g/mol
IUPAC Name
2-hexadecan-2-yl-4,6-dimethylphenol

Chemical Identifiers

InChI
InChI=1S/C24H42O/c1-5-6-7-8-9-10-11-12-13-14-15-16-17-21(3)23-19-20(2)18-22(4)24(23)25/h18-19,21,25H,5-17H2,1-4H3
InChI Key
TVWGHFVGFWIHFN-UHFFFAOYSA-N

Overview

2-hexadecan-2-yl-4,6-dimethylphenol (CAS 134701-20-5) is an alkylated phenolic compound with antioxidant properties and a long-chain aliphatic substituent. This specialized phenolic derivative features a distinctive molecular structure combining a phenol ring with methyl groups at positions 4 and 6, along with a substantial hexadecyl chain at the 2-position. With a molecular formula of C24H42O and molecular weight of 346.6 g/mol, this compound belongs to the family of sterically hindered phenols commonly employed as antioxidants and stabilizers in various industrial applications. The compound exhibits notable lipophilic characteristics due to its extended alkyl chain, which influences both its solubility profile and its effectiveness in different matrix systems. Safety considerations are important when handling this material, as it is classified under GHS regulations with Warning signal word and presents skin irritation and sensitization potential (Skin Irrit. 2; Skin Sens. 1). Additionally, it poses significant aquatic toxicity concerns (Aquatic Acute 1; Aquatic Chronic 1), requiring careful environmental management during use and disposal. Industrial applications typically include polymer stabilization, particularly in polyolefins and other synthetic materials where long-term thermal and oxidative stability are crucial. The compound also finds use in lubricant formulations and specialty chemical systems requiring robust antioxidant protection. Its structural similarity to related compounds like 4-tert-butyl-2-hexadecan-2-yl-6-methylphenol makes it valuable in formulations where specific performance characteristics are required. Transport classification under ADR Class 9 reflects its status as a miscellaneous dangerous substance, necessitating appropriate handling protocols during logistics operations. OYSI maintains reliable supply capabilities for 2-hexadecan-2-yl-4,6-dimethylphenol to serve the European technical chemicals market with consistent quality and regulatory compliance.

Safety & Classification

Warning
Classification:

Skin Irrit. 2; Skin Sens. 1; Aquatic Acute 1; Aquatic Chronic 1

HHazard Statements (H-Statements)

Describe the nature and severity of the hazard

H315

Causes skin irritation.

H317

May cause an allergic skin reaction.

H400

Very toxic to aquatic life.

H410

Very 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:

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 Name2,4-Dimethyl-6-(1-methylpentadecyl)phenol
Marine PollutantNo

Frequently Asked Questions

What is 2-hexadecan-2-yl-4,6-dimethylphenol?

2-hexadecan-2-yl-4,6-dimethylphenol is an organic chemical compound with the molecular formula C24H42O and CAS number 134701-20-5. This phenolic compound has a molecular weight of 346.6 g/mol and features a long alkyl chain attached to a dimethylphenol structure. It is classified as a hazardous substance with skin irritation and sensitization properties, as well as aquatic toxicity concerns.

What are the physicochemical properties of 2-hexadecan-2-yl-4,6-dimethylphenol?

2-hexadecan-2-yl-4,6-dimethylphenol is a large organic molecule with molecular formula C24H42O and molecular weight 346.6 g/mol. Due to its long alkyl chain and phenolic structure, it is likely to be a viscous liquid or waxy solid at room temperature with limited water solubility. The compound's lipophilic nature makes it more soluble in organic solvents and oils.

What is 2-hexadecan-2-yl-4,6-dimethylphenol used for?

2-hexadecan-2-yl-4,6-dimethylphenol is primarily used as an antioxidant additive in various industrial applications. Its phenolic structure provides excellent antioxidant properties, making it valuable for stabilizing polymers, lubricants, and other materials against oxidative degradation. It may also find applications in specialty chemical formulations where long-term stability and protection against oxidation are required.

How to handle 2-hexadecan-2-yl-4,6-dimethylphenol safely?

2-hexadecan-2-yl-4,6-dimethylphenol must be handled with appropriate personal protective equipment due to its skin irritation and sensitization potential. Use chemical-resistant gloves, safety goggles, and protective clothing to prevent skin and eye contact. Ensure adequate ventilation in work areas and avoid generating dust or vapors. Follow good industrial hygiene practices and wash hands thoroughly after handling.

How to store 2-hexadecan-2-yl-4,6-dimethylphenol correctly?

2-hexadecan-2-yl-4,6-dimethylphenol should be stored in a cool, dry, well-ventilated area away from heat sources and incompatible materials. Keep containers tightly closed and properly labeled according to GHS requirements. Store away from oxidizing agents and strong bases. Ensure storage areas are equipped with appropriate spill containment measures and maintain temperature control to prevent degradation.

What to do in case of contact with 2-hexadecan-2-yl-4,6-dimethylphenol?

In case of skin contact with 2-hexadecan-2-yl-4,6-dimethylphenol, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. For eye contact, flush immediately with clean water for 15 minutes. If irritation persists or allergic reactions develop, seek medical attention promptly. Remove contaminated clothing and wash before reuse.

How to dispose of 2-hexadecan-2-yl-4,6-dimethylphenol properly?

2-hexadecan-2-yl-4,6-dimethylphenol must be disposed of in accordance with local, national, and EU waste regulations due to its environmental hazard classification. Contact licensed waste disposal companies for proper treatment and disposal. Do not discharge to sewers, waterways, or soil due to its aquatic toxicity. Small quantities may require incineration at authorized facilities with appropriate emission controls.

How to transport 2-hexadecan-2-yl-4,6-dimethylphenol?

2-hexadecan-2-yl-4,6-dimethylphenol is classified as ADR Class 9 (Miscellaneous dangerous goods), Packing Group III for transportation purposes. It requires appropriate UN-specification packaging and hazard labels during transport. Shipping documents must include proper shipping names and hazard information. Transport vehicles should be equipped with appropriate emergency equipment and drivers must be trained in ADR regulations.

Is 2-hexadecan-2-yl-4,6-dimethylphenol subject to specific regulations?

2-hexadecan-2-yl-4,6-dimethylphenol is subject to EU REACH regulation for registration and authorization requirements. It must be classified and labeled according to CLP regulation with Warning signal word and GHS07/GHS09 pictograms. While not currently listed as a SVHC substance, its skin sensitization and aquatic toxicity properties require compliance with occupational health and environmental protection measures.

Where to buy 2-hexadecan-2-yl-4,6-dimethylphenol in Europe?

2-hexadecan-2-yl-4,6-dimethylphenol is available through OYSI, a specialized European distributor of technical chemicals. OYSI provides this compound with full regulatory compliance documentation including safety data sheets and certificates of analysis. As a professional chemical distributor, OYSI ensures proper packaging, labeling, and transport arrangements according to European regulations for industrial customers across Europe.

Data Sources

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