4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol
C18H18O4S
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Identification
- CAS Number
- 41481-66-7
- EC Number
- 411-570-9
- UN Number
- 3077
- Index Number
- 016-075-00-8
- PubChem CID
- 833466
Physical-chemical properties
- Molecular Formula
- C18H18O4S
- Molar Mass
- 330.40 g/mol
- IUPAC Name
- 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol
Chemical Identifiers
- InChI
- InChI=1S/C18H18O4S/c1-3-5-13-11-15(7-9-17(13)19)23(21,22)16-8-10-18(20)14(12-16)6-4-2/h3-4,7-12,19-20H,1-2,5-6H2
- InChI Key
- MTMKZABGIQJAEX-UHFFFAOYSA-N
Overview
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol (CAS 41481-66-7) is an organic sulfone compound featuring dual allyl-substituted phenolic groups with notable chemical reactivity. This specialized chemical compound, also identified by EC number 411-570-9, represents a sophisticated sulfone derivative characterized by its unique molecular structure containing two phenolic rings connected through a sulfonyl bridge. With a molecular formula of C18H18O4S and molecular weight of 330.4 g/mol, this compound exhibits distinctive properties due to the presence of both hydroxyl groups and allyl substituents on aromatic rings. The compound's safety profile requires careful handling protocols, as it is classified under GHS pictograms GHS07 and GHS09 with a "Warning" signal word. The classification as Skin Sens. 1 indicates potential for skin sensitization, while the Aquatic Chronic 2 designation reflects environmental considerations for aquatic ecosystems. Transportation falls under ADR Class 9, categorizing it as a miscellaneous dangerous substance. The dual allyl functionality provides opportunities for polymerization and cross-linking reactions, making this compound valuable in advanced materials applications. Its phenolic structure offers antioxidant potential and chemical modification possibilities. Unlike simpler compounds such as 2-phenylsulfanylaniline, this sulfone derivative presents enhanced thermal stability and unique reactivity patterns. Industrial applications typically include specialized polymer synthesis, where the allyl groups enable controlled cross-linking, advanced composite manufacturing requiring precise chemical modifications, and specialty chemical intermediates for pharmaceutical or agrochemical synthesis. The compound's structural complexity makes it particularly suitable for applications demanding specific reactivity profiles. OYSI maintains reliable supply chains for this specialized sulfone compound, ensuring consistent availability for industrial customers across European markets.
Safety & Classification
Skin Sens. 1; Aquatic Chronic 2
GHS Pictograms
HHazard Statements (H-Statements)
Describe the nature and severity of the hazard
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
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 Number | 3077 |
| ADR Class | 9 |
| Packing Group | III |
| Tunnel Code | - |
| Proper Shipping Name | 2,2'-Diallyl-4,4'-sulfonyldiphenol |
| Marine Pollutant | No |
Frequently Asked Questions
What is 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol?
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol is an organic chemical compound with the molecular formula C18H18O4S and CAS number 41481-66-7. This substance has a molecular weight of 330.4 g/mol and contains both phenolic and sulfonyl functional groups with allyl substituents. It is classified as a skin sensitizer and poses chronic aquatic toxicity risks, requiring careful handling in industrial applications.
What are the physicochemical properties of 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol?
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol is a solid organic compound with a molecular weight of 330.4 g/mol. The presence of phenolic hydroxyl groups and the sulfonyl bridge suggests moderate polarity, likely affecting its solubility in polar and non-polar solvents. The allyl groups contribute to potential reactivity under certain conditions. Specific physical properties such as melting point and exact solubility data would require detailed analytical characterization.
What is 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol used for?
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol is typically used as a chemical intermediate in organic synthesis and specialty chemical manufacturing. Its unique structure with phenolic and sulfonyl functionalities makes it suitable for applications in polymer chemistry, pharmaceutical intermediates, or as a building block for more complex molecules. The specific industrial applications depend on the reactive properties of its functional groups and the desired end products.
How to handle 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol safely?
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol requires careful handling due to its skin sensitization properties (Skin Sens. 1). Wear appropriate personal protective equipment including chemical-resistant gloves, safety goggles, and protective clothing. Ensure adequate ventilation in work areas and avoid direct skin contact. Handle in a well-ventilated area or under a fume hood. Follow good industrial hygiene practices and have emergency washing facilities readily available.
How to store 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol correctly?
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenyl should be stored in a cool, dry, well-ventilated area away from incompatible materials. Keep containers tightly closed and protected from moisture and direct sunlight. Store away from sources of heat and ignition. Due to its aquatic toxicity classification, ensure proper containment to prevent environmental release. Follow local regulations for chemical storage and maintain appropriate spill control measures in the storage area.
What to do in case of contact with 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol?
Immediate action is required upon contact with 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol due to its skin sensitization properties. For skin contact, immediately remove contaminated clothing and wash the affected area thoroughly with soap and water for at least 15 minutes. In case of eye contact, flush immediately with clean water for 15 minutes. If inhaled, move to fresh air. Seek medical attention if irritation persists or develops, especially given the sensitization potential.
How to dispose of 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol appropriately?
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol must be disposed of according to local and national hazardous waste regulations due to its classification as Aquatic Chronic 2. Do not discharge to sewers or the environment. Contact licensed waste disposal companies for proper treatment and disposal. The material should be handled as hazardous waste and may require incineration at high temperatures in authorized facilities. Maintain proper documentation for waste tracking and disposal records.
How to transport 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol?
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol is classified as ADR Class 9 (Miscellaneous Dangerous Goods), Packing Group III for transportation. This indicates it presents a relatively lower degree of danger during transport but still requires proper packaging and documentation. Use appropriate UN-specification packaging, ensure proper labeling with Class 9 hazard labels, and include transport documents. Follow ADR regulations for loading, segregation, and vehicle requirements when shipping this material.
Is 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenyl subject to specific regulations?
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol is subject to standard REACH and CLP regulations in Europe as a chemical substance. It is not currently listed as a Substance of Very High Concern (SVHC). The substance must be properly classified and labeled according to CLP with Warning signal word and appropriate GHS pictograms (GHS07, GHS09). Registration requirements under REACH apply depending on import/manufacture volumes and uses within the European Economic Area.
Where to buy 4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol in Europe?
4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol is available through OYSI, a European distributor of specialty chemicals and technical products. OYSI provides professional chemical distribution services across Europe, ensuring proper handling, documentation, and regulatory compliance. Contact OYSI directly for availability, technical specifications, safety data sheets, and pricing information. As a specialized chemical intermediate, this substance is typically supplied to industrial and research customers with appropriate safety and handling capabilities.
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4-(4-hydroxy-3-prop-2-enylphenyl)sulfonyl-2-prop-2-enylphenol is a dangerous good. We support you with labeling, packaging, and transport documentation.
Data Sources
Classification per CLP Regulation (EC) No 1272/2008. Data from ECHA and PubChem.