Basic information
- CAS
16111-62-9- Standard SMILES
CCCCC(CC)COC(=O)OOC(=O)OCC(CC)CCCC- InChIKey
ZACVGCNKGYYQHA-UHFFFAOYSA-N- Molecular formula
- C18H34O6
- Average molar mass
- 346.5 g/mol
- Monoisotopic mass
- 346.23553881
Overview
This liquid peroxide is particularly sensitive to temperature rises. Above a given "Control Temperature" they decompose violently. They are generally stored or transported in a solvent slurry.
Names & identifiers
- Preferred name
- Peroxydicarbonic acid, C,C'-bis(2-ethylhexyl) ester
- IUPAC
- 2-ethylhexoxycarbonyloxy 2-ethylhexyl carbonate
- English name
- Di-(2-ethylhexyl)peroxydicarbonate
- Molecular formula
- C18H34O6
- Molecular weight
- 346.46
Names & synonyms
16111-62-9Peroxydicarbonic acid, bis(2-ethylhexyl) esterDi(2-ethylhexyl) peroxydicarbonateBis(2-ethylhexyl) peroxydicarbonateEINECS 240-282-4BRN 5964960di-(2-Ethylhexyl)peroxydicarbonateDTXSID5027778Peroxydicarbonic acid, di(2-ethylhexyl) esterEC 240-282-4Peroxydicarbonic acid, C,C'-bis(2-ethylhexyl) esterDI-(2-ETHYLHEXYL) PEROXYDICARBONATE, (TECHNICALLY PURE)
Show more names
Lupersol 223Trigonox EHP-C75Trigonox EHP-W60Trigonox EHPS-C75Initiating agent EHPDEHP peroxydicarbonate2-Ethylhexyl percarbonateBis(2-ethylhexyl) perdicarbonate
DI-(2-ETHYLHEXYL) PEROXYDICARBONATE, [TECHNICALLY PURE]RefChem:860365ESPERCARB 840MTRIGONOX EHP-W 40DTXCID407778di-2-ethylhexyl peroxydicarbonate240-282-42-ethylhexoxycarbonyloxy 2-ethylhexyl carbonate
Database identifiers
Properties
Computed structural properties
- XLogP
- 7.3
- Topological polar surface area
- 71.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 17
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 299
Experimental & physicochemical properties
Physical Description
This liquid peroxide is particularly sensitive to temperature rises. Above a given "Control Temperature" they decompose violently. They are generally stored or transported in a solvent slurry.
Liquid; CBI
Physicochemical properties
- Boiling point
- 401.18 °C · 401.18°C (rough estimate)
- Density
- 1.0722 · 1.0722 (rough estimate)
- vapor pressure
- 0.001 Pa · 0.001Pa at 25℃
- refractive index
- 1.445 · 1.4450 (estimate)
- Water Solubility
- 880 mg/L · 880mg/L at 25℃
- Stability
- Unstable if heated. Heating presents a potential risk of explosion. May be shock sensitive. Flammable. May react violently with organic materials.
- LogP
- 2.73 · 2.73
- EWG's Food Scores
- 1 · 1
- EPA Substance Registry System
- Peroxydicarbonic acid, bis(2-ethylhexyl) ester (16111-62-9)
Safety & regulation
GHS classification
GHS Classification
Danger
H242 (100%): Heating may cause a fire [Danger Self-reactive substances and mixtures; Organic peroxides]
P210, P234, P235, P240, P261, P264, P264+P265, P270, P272, P280, P301+P317, P302+P352, P305+P351+P338, P321, P330, P332+P317, P333+P317, P337+P317, P362+P364, P370+P378, P403, P410, P411, P420, and P501 (click each P-code to see the statement)
Aggregated GHS information provided per 559 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.
Hazard information
Regulatory Information
Chemical: Peroxydicarbonic acid, bis(2-ethylhexyl) ester
Peroxydicarbonic acid, C,C'-bis(2-ethylhexyl) ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Peroxydicarbonic acid, C,C'-bis(2-ethylhexyl) ester are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)
Status: Active Update: 31-05-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/14207
Peroxydicarbonic acid, bis(2-ethylhexyl) ester: Does not have an individual approval but may be used as a component in a product covered by a group standard. It is not approved for use as a chemical in its own right.
DOT LabelOrganic Peroxide
Fire HazardsExcerpt from ERG Guide 148 [Organic Peroxides (Heat and Contamination Sensitive / Temperature Controlled)]:
Health HazardsExcerpt from ERG Guide 148 [Organic Peroxides (Heat and Contamination Sensitive / Temperature Controlled)]:
Reactive GroupPeroxides, Organic
Reactivity AlertsExplosive
Chemistry & industry
Uses & manufacturing
U.S. Production2023: 4,000,000 - <5,500,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesPolymerization promoter
General Manufacturing Information
Plastics Material and Resin Manufacturing
Peroxydicarbonic acid, C,C'-bis(2-ethylhexyl) ester: ACTIVE
Applications
UsesDi-(2-ethylhexyl)peroxydicarbonate is used as free radical type initiator, can be used as an initiator for vinyl chloride, high-pressure polyethylene and other copolymers, and can also be used in polyisoprene rubber to improve its strength.
General DescriptionDi-(2-ethylhexyl)peroxydicarbonate is particularly sensitive to temperature rises. Above a given "Control Temperature" they decompose violently. They are generally stored or transported in a solvent slurry.
Upstream & downstream products
Upstream raw materials
Suppliers31 total
Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]
Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]
Related reactions
7 records
Compound notes
Loading…