Grundinformationen
- Standard-SMILES
CC(C)(C)OOC(C)(C)c1ccccc1- InChIKey
BIISIZOQPWZPPS-UHFFFAOYSA-N- Summenformel
- C13H20O2
- Durchschnittliche Molmasse
- 208,3 g/mol
- Monoisotopische Masse
- 208,14632988
Namen und Bezeichner
- Bevorzugter Name
- Tert-butyl cumene peroxide
- IUPAC
- 2-tert-butylperoxypropan-2-ylbenzene
- Lokaler Name
- tert-Butyl-α,α-dimethylbenzylperoxid
- Englischer Name
- TERT-BUTYL CUMYL PEROXIDE
- Summenformel
- C13H20O2
- Molmasse
- 208.3
Namen und Synonyme
tert-Butyl cumyl peroxide3457-61-2Luperco 801-XLPeroxide, 1,1-dimethylethyl 1-methyl-1-phenylethylJ78XB9M8IRtert-Butyl alpha,alpha-dimethylbenzyl peroxidetert-butyl-cumyl peroxideEINECS 222-389-8tert-Butyl cumene peroxide1,1-Dimethylethyl 1-methyl-1-phenylethyl peroxideTERT-BUTYLCUMENEPEROXIDEDTXSID9063039
Weitere Namen anzeigen
t-Butyl cumyl peroxideNA-2091Trigonox TKayabutyl CLuperox 801Luperox D 16Peroximon 801
EC 222-389-8TERT-BUTYL CUMYL PEROXIDE, (TECHNICALLY PURE)TERT-BUTYL CUMYL PEROXIDE, [TECHNICALLY PURE]PERBUTYL CRefChem:894642PEROXIMON 166TRIGONOX T 40LUPERSOL 801
Datenbank-Bezeichner
- CAS
30026-92-7、3457-61-2- PubChem CID
- 76997
- DTXSID
DTXSID9063039- UNII
- J78XB9M8IR
- EC Number
- 222-389-8
- Nikkaji
- J3.053H
Eigenschaften
Berechnete Struktureigenschaften
- XLogP
- 3,2
- Polarare Oberfläche (TPSA)
- 18,5 Ų
- H-Brücken-Donoren
- 0
- H-Brücken-Akzeptoren
- 2
- Frei drehbare Bindungen
- 4
- Schwere Atome
- 15
- Formalladung
- 0
- Komplexität
- 185
Experimentelle und physikochemische Eigenschaften
SpringerMaterials PropertiesBoiling point
Physical DescriptionCBI; Liquid
Physikochemische Eigenschaften
- Schmelzpunkt
- 5 · 5-8 °C
- Siedepunkt
- 287.5 °C · 287.5°C (rough estimate)
- Dichte
- 0.94 · 0.94
- Dampfdruck
- 14 Pa · 14Pa at 40℃
- Brechungsindex
- 1.419 · 1.419-1.423
- Flammpunkt
- 72 °C · 72 °C
- storage temp.
- Indoors
- Wasserlöslichkeit
- 10.66 mg/L · 10.66mg/L at 20℃
- Henry's Law Constant
- 1.4 · 1.4×10-2 mol/(m3Pa) at 25℃, Zhang et al. (2010)
- LogP
- 4.4 at · 4.4 at 25℃
- CAS Datenbank
- 3457 · 3457-61-2
- EPA chemische Informationen
- 1 · Peroxide, 1,1-dimethylethyl 1-methyl-1-phenylethyl (3457-61-2)
Sicherheit und Regulatorisches
GHS-Klassifizierung
GHS Classification
Warning
H242: Heating may cause a fire [Danger Self-reactive substances and mixtures; Organic peroxides]
P210, P234, P235, P240, P264, P273, P280, P302+P352, P321, P332+P317, P362+P364, P370+P378, P391, P403, P410, P411, P420, and P501 (click each P-code to see the statement)
Danger
H242 (100%): Heating may cause a fire [Danger Self-reactive substances and mixtures; Organic peroxides]
P210, P234, P235, P240, P261, P264, P272, P273, P280, P302+P352, P321, P332+P317, P333+P317, P362+P364, P370+P378, P391, P403, P410, P411, P420, and P501 (click each P-code to see the statement)
Gefahrenhinweise
Regulatory Information
Chemical: Peroxide, 1,1-dimethylethyl 1-methyl-1-phenylethyl
Peroxide, 1,1-dimethylethyl 1-methyl-1-phenylethyl is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Peroxide, 1,1-dimethylethyl 1-methyl-1-phenylethyl 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: 17-07-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/13239
DOT LabelOrganic Peroxide
Fire HazardsExcerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Health HazardsExcerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Reactive GroupPeroxides, Organic
Reactivity AlertsExplosive
Reactivity Profile
Peroxides, such as TERT-BUTYL CUMENE 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. May explode from heat or contamination. May ignite combustibles (wood, paper, oil, clothing, etc.). May be ignited by heat, sparks or flames.
Air and Water ReactionsNo rapid reaction with air. No rapid reaction with water.
Hazard Classes and Categories
Org. Perox. E (100%)
Organic peroxide - type E
Flammable liquids - Category 3
Org. Perox. E
Sicherheit und Schutzausrüstung
Fire FightingExcerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
First AidExcerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Nonfire Spill ResponseExcerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Isolation and EvacuationExcerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Personal Protective Equipment (PPE)Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:
Sicherheitsdaten
- tsca
- TSCA listed
- ridadr
- 3105
- hs_code
- 29096000
- risk_code
- 7-51/53-38
- hazard_code
- N-Xi-O,N,Xi,O
- safety_code
- 61-36/37/39-3/7-14A-14
- hazard_class
- 5.2
- packing_group
- II
Chemie und Industrie
Verwendung und Herstellung
U.S. Production2023: 250,000 - <400,000 lb
Industry UsesChemical reaction regulator
General Manufacturing Information
Rubber Product Manufacturing
Peroxide, 1,1-dimethylethyl 1-methyl-1-phenylethyl: ACTIVE
Anwendungen
Verwenden1,1-Dimethylethyl 1-methyl-1-phenylethyl Peroxide (Technical Grade) acts as a crosslinking peroxide in polymerization reactions.
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