Basic information
- CAS
762-16-3- Standard SMILES
CCCCCCCC(=O)OOC(=O)CCCCCCC- InChIKey
SRSFOMHQIATOFV-UHFFFAOYSA-N- Molecular formula
- C16H30O4
- Average molar mass
- 286.41 g/mol
- Monoisotopic mass
- 286.21440943
Names & identifiers
- Preferred name
- Caprylyl peroxide
- IUPAC
- octanoyl octaneperoxoate
- English name
- dioctanoyl peroxide
- Molecular formula
- C16H30O4
- Molecular weight
- 286.41
Names & synonyms
Show more names
Database identifiers
- CAS
762-16-3- PubChem CID
- 12979
- DTXSID
DTXSID0061086- UNII
- H709TZ1FAF
- EC Number
- 212-094-2
- Nikkaji
- J5.230B
Properties
Computed structural properties
- XLogP
- 6.2
- Topological polar surface area
- 52.6 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 15
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 225
Experimental & physicochemical properties
Physical Description
Straw-colored liquid; sharp odor.
Straw-colored liquid with a sharp odor; Immiscible with water; [Hawley]
Physicochemical properties
- Melting point
- 29 °C · 29 °C
- Boiling point
- 348.77 °C · 348.77°C (rough estimate)
- Density
- 0.9903 · 0.9903 (rough estimate)
- vapor pressure
- 0.1 Pa · 0.1Pa at 20℃
- refractive index
- 1.434 · 1.4340 (estimate)
- Water Solubility
- 7 μg/L · 7μg/L at 20℃
- LogP
- 6.5 at · 6.5 at 25℃
- FDA UNII
- 709 TZ1FAF · H709TZ1FAF
- EPA Substance Registry System
- Peroxide, bis(1-oxooctyl) (762-16-3)
- Symbol(GHS)
- 2 · GHS02,GHS07
- Signal word
- Danger
- Hazard statements
- 242 · H242-H315-H317
- Precautionary statements
- 210 · P210-P234-P235-P240-P280-P264-P261-P272-P370+P378-P302+P352-P332+P313-P362+P364-P333+P313-P403-P410-P411-P420-P501
- RIDADR
- 3106 · 3106
- TSCA
- TSCA listed
- HazardClass
- 5.2 · 5.2
- PackingGroup
- II
- Hazardous Substances Data
- 762 · 762-16-3(Hazardous Substances Data)
- REACH Registrations
- Active
Safety & regulation
GHS classification
GHS Classification
Danger
H242 (100%): Heating may cause a fire [Danger Self-reactive substances and mixtures; Organic peroxides];H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation];H317 (100%): May cause an allergic skin reaction [Warning Sensitization, Skin]
P210, P234, P235, P240, P261, P264, P272, P280, P302+P352, P321, P332+P317, P333+P317, P362+P364, P370+P378, P403, P410, P411, P420, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 2 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.;Information may vary between notifications depending on impurities, additives, and other factors. The percentage value in parenthesis indicates the notified classification ratio from companies that provide hazard codes. Only hazard codes with percentage values above 10% are shown. For more detailed information, please visit ECHA C&L website.
Hazard information
Regulatory Information
Chemical: Peroxide, bis(1-oxooctyl)
Status: Active Update: 11-06-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/22074
Fire Hazards
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:;May explode from heat or contamination. May ignite combustibles (wood, paper, oil, clothing, etc.). May be ignited by heat, sparks or flames. May burn rapidly with flare-burning effect. Containers may explode when heated. Runoff may create fire or explosion hazard. (ERG, 2024)
Health Hazards
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:;Fire may produce irritating, corrosive and/or toxic gases. Ingestion or contact (skin, eyes) with substance may cause severe injury or burns. Runoff from fire control or dilution water may cause environmental contamination. (ERG, 2024)
Reactivity Profile
Peroxides, such as CAPRYLYL PEROXIDE, are good oxidizing agents. Organic compounds can ignite on contact with concentrated peroxides. Strongly reduced material such as sulfides, nitrides, and hydrides may react explosively with peroxides. There are few chemical classes that do not at least produce heat when mixed with peroxides. Many produce explosions or generate gases (toxic and nontoxic). Generally, dilute solutions of peroxides (<70%) are safe, but the presence of a catalyst (often a transition metal such as cobalt, iron, manganese, nickel, or vanadium) as an impurity may even then cause rapid decomposition, a buildup of heat, and even an explosion. Solutions of peroxides often become explosive when evaporated to dryness or near-dryness. Danger of explosion when dry
DOT Emergency Guidelines
/GUIDE 148: ORGANIC PEROXIDES (HEAT AND CONTAMINATION SENSITIVE/TEMPERATURE CONTROLLED )/ Fire or Explosion: May explode from heat, contamination or loss of temperature control. These materials are particularly sensitive to temperature rises. Above a given "Control Temperature" they decompose violently and catch fire. May ignite combustibles (wood, paper, oil, clothing, etc.). May ignite spontaneously if exposed to air. May be ignited by heat, sparks or flames. May burn rapidly with flare-burning effect. Containers may explode when heated. Runoff may create fire or explosion hazard. /Organic peroxide type C, solid, temperature controlled/
/GUIDE 148: ORGANIC PEROXIDES (HEAT AND CONTAMINATION SENSITIVE/TEMPERATURE CONTROLLED )/ Health: Fire may produce irritating, corrosive and/or toxic gases. Ingestion or contact (skin, eyes) with substance may cause severe injury or burns. Runoff from fire control or dilution water may cause pollution. /Organic peroxide type C, solid, temperature controlled/
/GUIDE 148: ORGANIC PEROXIDES (HEAT AND CONTAMINATION SENSITIVE/TEMPERATURE CONTROLLED )/ Public Safety: CALL Emergency Response Telephone Number ... . As an immediate precautionary measure, isolate spill or leak area in all directions for at least 50 (150 feet) for liquids and at least 25 meters (75 feet) for solids. Keep unauthorized personnel away. Stay upwind. Keep out of low areas. DO NOT allow the substance to warm up. Obtain liquid nitrogen, dry ice or ice for cooling. If none can be obtained, evacuate the area immediately. /Organic peroxide type C, solid, temperature controlled/
/GUIDE 148: ORGANIC PEROXIDES (HEAT AND CONTAMINATION SENSITIVE/TEMPERATURE CONTROLLED )/ Protective Clothing: Wear positive pressure self-contained breathing apparatus (SCBA). Wear chemical protective clothing that is specifically recommended by the manufacturer. It may provide little or no thermal protection. Structural firefighters' protective clothing will only provide limited protection. /Organic peroxide type C, solid, temperature controlled/
For more DOT Emergency Guidelines (Complete) data for CAPRYLYL PEROXIDE (8 total), please visit the HSDB record page.
Safety & protection
Fire Fighting
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:;SMALL FIRE: Water spray or fog is preferred; if water not available use dry chemical, CO2 or regular foam.;LARGE FIRE: Flood fire area with water from a distance. Use water spray or fog; avoid aiming straight or solid streams directly onto the product. Do not move cargo or vehicle if cargo has been exposed to heat. If it can be done safely, move undamaged containers away from the area around the fire.;FIRE INVOLVING TANKS, RAIL TANK CARS OR HIGHWAY TANKS: Fight fire from maximum distance or use unmanned master stream devices or monitor nozzles. Cool containers with flooding quantities of water until well after fire is out. ALWAYS stay away from tanks in direct contact with flames. For massive fire, use unmanned master stream devices or monitor nozzles; if this is impossible, withdraw from area and let fire burn. (ERG, 2024)
Fire Fighting Procedures
In case of fire, water should be applied by the sprinkler system or by hose from a safe distance, preferably with a fog nozzle. Foam may be necessary instead if the peroxide is diluted in a low density flammable solvent. Portable extinguishers should not be used except for very small fires. Peroxides threatened by fire should be wetted from a safe distance for cooling. /Peroxides, Organic and Inorganic/
Storage Conditions
MATERIALS WHICH ARE TOXIC AS STORED OR WHICH CAN DECOMPOSE INTO TOXIC COMPONENTS...SHOULD BE STORED IN A COOL WELL VENTILATED PLACE, OUT OF THE DIRECT RAYS OF THE SUN, AWAY FROM AREAS OF HIGH FIRE HAZARD, AND SHOULD BE PERIODICALLY INSPECTED. INCOMPATIBLE MATERIALS SHOULD BE ISOLATED... /CAPRYLYL PEROXIDE SOLUTION/
Cleanup Methods
Spills should be cleaned up promptly using non-sparking tools and an inert, moist diluent such as vermiculite or sand. Sweepings may be placed in open containers or polyethylene bags and the area washed with water and detergent. Spilled, contaminated, waste or questionable peroxides should be destroyed. /Peroxides, Organic and Inorganic/
Most peroxides can be hydrolyzed by adding them slowly with stirring to about ten times their weight of cold 10% sodium hydroxide solution. The reaction may require several hours. /Peroxides, Organic and Inorganic/
Dilute and drain into the sewer with abundant water.
Nonfire Spill Response
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:;ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area. Keep combustibles (wood, paper, oil, etc.) away from spilled material. Do not touch damaged containers or spilled material unless wearing appropriate protective clothing. Keep substance wet using water spray. Stop leak if you can do it without risk.;SMALL SPILL: Pick up with inert, damp, non-combustible material using clean, non-sparking tools and place into loosely covered plastic containers for later disposal.;LARGE SPILL: Wet down with water and dike for later disposal. Prevent entry into waterways, sewers, basements or confined areas. DO NOT CLEAN-UP OR DISPOSE OF, EXCEPT UNDER SUPERVISION OF A SPECIALIST. (ERG, 2024)
Disposal Methods
SRP: At the time of review, criteria for land treatment or burial (sanitary landfill) disposal practices are subject to significant revision. Prior to implementing land disposal of waste residue (including waste sludge), consult with environmental regulatory agencies for guidance on acceptable disposal practices.
Isolation and Evacuation
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:;IMMEDIATE PRECAUTIONARY MEASURE: Isolate spill or leak area in all directions for at least 50 meters (150 feet) for liquids and at least 25 meters (75 feet) for solids.;LARGE SPILL: Consider initial evacuation for at least 250 meters (800 feet) in all directions.;FIRE: If tank, rail tank car or highway tank is involved in a fire, ISOLATE for 800 meters (1/2 mile) in all directions; also, consider initial evacuation for 800 meters (1/2 mile) in all directions. (ERG, 2024)
Personal Protective Equipment (PPE)
Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:;Wear positive pressure self-contained breathing apparatus (SCBA). Wear chemical protective clothing that is specifically recommended by the manufacturer when there is NO RISK OF FIRE. Structural firefighters' protective clothing provides thermal protection but only limited chemical protection. (ERG, 2024)
Persons handling peroxides should use safety glasses with side shields, goggles or face shield for eye protection. Emergency eyewash facilities should be provided. Gloves, aprons and other protective clothing as necessary should be used to prevent skin contact. Clothing and equipment that generate static electricity should be avoided. Smoking should be prohibited. /Peroxides, Organic and Inorganic/
Toxicology
Antidote and Emergency Treatment
Basic treatment: Establish a patent airway. Suction if necessary. Watch for signs of respiratory insufficiency and assist ventilations if necessary. Administer oxygen by nonrebreather mask at 10 to 15 L/min. Monitor for pulmonary edema and treat if necessary ... . Monitor for shock and treat if necessary ... . Anticipate seizures and treat if necessary ... . For eye contamination, flush eyes immediately with water. Irrigate each eye continuously with normal saline during transport ... . Do not use emetics. For ingestion, rinse mouth and administer 5 ml/kg up to 200 ml of water for dilution if the patient can swallow, has a strong gag reflex, and does not drool .... . Do not attempt to neutralize because of exothermic reaction. Cover skin burns with dry, sterile dressings after decontamination ... . /Organic peroxides/
Advanced treatment: Consider orotracheal or nasotracheal intubation for airway control in the patient who is unconscious, has severe pulmonary edema, or is in respiratory arrest. Early intubation, at the first sign of upper airway obstruction, may be necessary. Positive pressure ventilation techniques with a bag valve mask device may be beneficial. Monitor cardiac rhythm and treat arrhythmias if necessary ... . Start an IV with D5W /SRP: "To keep open", minimal flow rate/. Use lactated Ringer's if signs of hypovolemia are present. Watch for signs of fluid overload. Consider drug therapy for pulmonary edema ... . For hypotension with signs of hypovolemia, administer fluid cautiously. Watch for signs of fluid overload ... . Treat seizures with diazepam (Valium) ... . Use proparacaine hydrochloride to assist eye irrigation ... . /Organic peroxides/
Peroxides should be washed promptly from the skin to prevent irritation. In the case of eye contact, the eyes should be flushed immediately with large amounts of water, and medical attention should be obtained. ... Medical attention should also be obtained in case of accidental ingestion. ... /Peroxides, Organic and Inorganic/
Regulatory information
Regulatory Information
Chemical: Peroxide, bis(1-oxooctyl)
Status: Active Update: 11-06-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/22074
Safety data
- tsca
- TSCA listed
- ridadr
- 3106
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS07
- hazard_class
- 5.2
- packing_group
- II
- Hazard statements
- H242-H315-H317
- REACH Registrations
- Active
- Precautionary statements
- P210-P234-P235-P240-P280-P264-P261-P272-P370+P378-P302+P352-P332+P313-P362+P364-P333+P313-P403-P410-P411-P420-P501
- Hazardous Substances Data
- 762-16-3(Hazardous Substances Data)
Chemistry & industry
Uses & manufacturing
Uses
Used as an initiator for suspension or mass polymerization of vinyl chloride monomers; [HSDB]
Initiator for suspension or mass polymerization of vinyl chloride monomers
Applications
UsesCaprylyl Peroxide is used as a catalyst in preparation of poly(vinyl chloride) latexes.
General DescriptionStraw-colored liquid; sharp odor.
Suppliers5 total
Related reactions
Compound notes
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