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Basic information
- Standard SMILES
CCCCC(CC)C(=O)OOC(C)(C)C- InChIKey
WYKYCHHWIJXDAO-UHFFFAOYSA-N- Molecular formula
- C12H24O3
- Average molar mass
- 216.321 g/mol
- Monoisotopic mass
- 216.17254463
Names & identifiers
- Preferred name
- tert-Butyl peroxy-2-ethylhexanoate
- IUPAC
- tert-Butyl 2-ethylhexaneperoxoate
- English name
- tert-Butyl peroxy-2-ethylhexanoate
- Molecular formula
- C12H24O3
- Molecular weight
- 216.32
Names & synonyms
Database identifiers
- CAS
3006-82-4- PubChem CID
- 102924
- DTXSID
DTXSID0027511- UNII
- KGA9W7ZS5I
- EC Number
- 221-110-7
- Nikkaji
- J3.044I
Properties
Physicochemical properties
- Melting point
- -30 °C · -30°C
- Boiling point
- 248.9 · 248.9±23.0 °C(Predicted)
- Density
- 0.89 · 0.89
- vapor pressure
- 2 Pa · 2Pa at 20℃
- Flash point
- 85 °C · 85°C
- pka
- -4.8 · -4.8[at 20 ℃]
- Water Solubility
- 46.3 mg/L · 46.3mg/L at 20℃
- InChI
- InChI=1S/C12H24O3/c1-6-8-9-10(7-2)11(13)14-15-12(3,4)5/h10H,6-9H2,1-5H3
- InChIKey
- WYKYCHHWIJXDAO-UHFFFAOYSA-N
- SMILES
- C(OOC(C)(C)C)(=O)C(CC)CCCC
- LogP
- 4.79 at · 4.79 at 20℃
- CAS DataBase Reference
- 3006 · 3006-82-4(CAS DataBase Reference)
- FDA UNII
- 9 W7ZS5I · KGA9W7ZS5I
- EPA Substance Registry System
- 2 · Hexaneperoxoic acid, 2-ethyl-, 1,1-dimethylethyl ester (3006-82-4)
- Symbol(GHS)
- 2 · GHS02,GHS08,GHS09
- Signal word
- Danger
- Hazard statements
- 242 · H242-H317-H360-H400-H411
- Precautionary statements
- 210 · P210-P220-P234-P280-P370+P378-P403+P235-P411-P420-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501
- RIDADR
- 2143 · UN 2143
- TSCA
- TSCA listed
- REACH Registrations
- Active
Safety & regulation
Safety data
- tsca
- TSCA listed
- ridadr
- UN 2143
- Signal word
- Danger
- Symbol(GHS)
- GHS02,GHS08,GHS09
- Hazard statements
- H242-H317-H360-H400-H411
- REACH Registrations
- Active
- Precautionary statements
- P210-P220-P234-P280-P370+P378-P403+P235-P411-P420-P501-P261-P272-P280-P302+P352-P333+P313-P321-P363-P501-P273-P391-P501
Chemistry & industry
Applications
UsesTert-Butyl peroxy-2-ethylhexanoate (TBPO), also known as Trigonox 21S or PEROXAN PO-30 , is an initiator for (co)polymerization of ethylene, styrene, acrylonitrile and (meth)acrylates. Curing agent for unsaturated polyester resins. It is used for high pressure polymerization of ethylene in both autoclave and tubular processes, usually in combination with other peroxides of varying degrees of activity.
General DescriptionThis peroxide is particularly sensitive to temperature rises and contamination. Above a given "Control Temperature" they decompose violently. tert-Butyl peroxy-2-ethylhexanoate is generally stored or transported with inert solids to mitigate the explosion hazard.
Upstream & downstream products
Upstream raw materials
Suppliers50 total
Related reactions
No reaction records under the current filter.
Linked notes
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