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cyclohexylidenbis[tert-butyl]peroxid

1,1-Bis(tert-butylperoxy)cyclohexane

HCID 76359
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Grundinformationen

CAS
3006-86-8
Standard-SMILES
CC(C)(C)OOC1(OOC(C)(C)C)CCCCC1
InChIKey
HSLFISVKRDQEBY-UHFFFAOYSA-N
Summenformel
C14H28O4
Durchschnittliche Molmasse
260,37 g/mol
Monoisotopische Masse
260,19875938

Überblick

Organic solvent solution, added to lessen explosion hazard.

Namen und Bezeichner

Bevorzugter Name
1,1-Bis(tert-butylperoxy)cyclohexane
IUPAC
1,1-bis(tert-butylperoxy)cyclohexane
Lokaler Name
cyclohexylidenbis[tert-butyl]peroxid
Englischer Name
1,1-Di(tert-butylperoxy)cyclohexane
Summenformel
C14H28O4
Molmasse
260.37

Namen und Synonyme

1,1-Bis(tert-butylperoxy)cyclohexane3006-86-8Cyclohexylidenebis(tert-butyl) peroxideUNII-JK62J3E3Q4JK62J3E3Q4EINECS 221-111-2PERHEXA CSLuperox 331M80Peroxide, 1,1'-cyclohexylidenebis(2-(1,1-dimethylethyl)EC 221-111-2PERHEXA C 40PERHEXA C 75
Weitere Namen anzeigen
1,1-bis(T-butylperoxy)cyclohexaneDP275BPerhexa-CChaloxyd PTrigonox 22Lupersol 331TRIGONOX(R) 22Luperox? 331P80
PEROXAN PK 122WTRIGONOX 22C50TRIGONOX 22E50TRIGONOX 22E70LUPEROX 331DTXSID4044907TX 22E50Cyclohexylidenebis[tert-butyl] peroxide

Datenbank-Bezeichner

CAS
3006-86-8
PubChem CID
76359
DTXSID
DTXSID4044907
UNII
JK62J3E3Q4

Eigenschaften

Berechnete Struktureigenschaften

XLogP
3,7
Polarare Oberfläche (TPSA)
36,9 Ų
H-Brücken-Donoren
0
H-Brücken-Akzeptoren
4
Frei drehbare Bindungen
6
Schwere Atome
18
Formalladung
0
Komplexität
224

Experimentelle und physikochemische Eigenschaften

Physical Description · 3 Einträge

Organic solvent solution, added to lessen explosion hazard.

Particularly heat and contamination sensitive.

CBI; Liquid

Physikochemische Eigenschaften

Schmelzpunkt
65 °C · 65 °C (SADT)
Siedepunkt
52 · 52-54 °C (0.1 mmHg)
Dichte
0.891 g/mL · 0.891 g/mL at 25 °C
Dampfdruck
4.88 hPa · 4.88hPa at 25℃
Brechungsindex
20 · n20/D 1.435
Flammpunkt
155 °F · 155 °F
storage temp.
2 · 2-8°C
Aggregatzustand
Liquid
Farbe
Clear
Wasserlöslichkeit
miscible
InChI
InChI=1S/C14H28O4/c1-12(2,3)15-17-14(10-8-7-9-11-14)18-16-13(4,5)6/h7-11H2,1-6H3

Sicherheit und Regulatorisches

Sicherheitsangaben dienen nur zur Orientierung und ersetzen weder das Sicherheitsdatenblatt (SDB) des Lieferanten noch geltende Vorschriften oder eine fachliche Bewertung.

GHS-Klassifizierung

GHS Classification · 6 Einträge

This chemical does not meet GHS hazard criteria for 1.8% (3 of 170) of reports.

Danger

H242 (74.7%): Heating may cause a fire [Danger Self-reactive substances and mixtures; Organic peroxides]

P210, P234, P235, P240, P261, P264, P264+P265, P271, P273, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P233, P405, P410, P411, P420, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 170 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

Gefahrenhinweise

Regulatory Information · 4 Einträge

Chemical: Peroxide, cyclohexylidenebis[(1,1-dimethylethyl)

Peroxide, 1,1'-cyclohexylidenebis[2-(1,1-dimethylethyl) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Peroxide, 1,1'-cyclohexylidenebis[2-(1,1-dimethylethyl) 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: 15-05-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/5875

Peroxide, cyclohexylidenebis(1,1-dimethylethyl): 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 Label · 4 Einträge

Organic Peroxide

Organic Peroxide

Organic Peroxide

Organic Peroxide Explosive

Fire Hazards · 4 Einträge

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Chemie und Industrie

Verwendung und Herstellung

U.S. Production2023: 1,000,000 - <2,500,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesCBI
General Manufacturing Information · 2 Einträge

Plastics Material and Resin Manufacturing

Peroxide, 1,1'-cyclohexylidenebis[2-(1,1-dimethylethyl): ACTIVE

Anwendungen

VerwendenPolymerization initiator.

Ergänzende Hinweise

Definition1,1-Di (tert-butylperoxy) cyclohexane (DTBPH) is a commercial liquid organic peroxide that is to be in aliphatic hydrocarbon solvent and transported and stored under limited temperature[1].

Zugehörige Reaktionen

6
Reaktionsaufzeichnung erstellen
Reaktionsgleichung von HRID 463539
HRID 463539als Eduktuspto-grants-1985_05
Reaktionsgleichung von HRID 568758
HRID 568758als Eduktuspto-grants-1988_03
Reaktionsgleichung von HRID 1649570
HRID 1649570als Eduktuspto-grants-1983_11
Reaktionsgleichung von HRID 1654593
HRID 1654593als Eduktuspto-grants-1995_04
Reaktionsgleichung von HRID 1680667
HRID 1680667als Eduktuspto-grants-1981_06
Reaktionsgleichung von HRID 1902737
HRID 1902737als Eduktuspto-grants-1982_12

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EC Number
221-111-2
Nikkaji
J4.394J
InChIKey
HSLFISVKRDQEBY-UHFFFAOYSA-N
SMILES
C1(CCCCC1)(OOC(C)(C)C)OOC(C)(C)C
LogP
7.2 at · 7.2 at 25℃
CAS Datenbank
3006 · 3006-86-8(CAS DataBase Reference)
EPA chemische Informationen
1 · Peroxide, 1,1'-cyclohexylidenebis[2-(1,1-dimethylethyl) (3006-86-8)

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Health Hazards · 4 Einträge

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Reactive Group · 4 Einträge

Peroxides, Organic

Peroxides, Organic

Peroxides, Organic

Peroxides, Organic

Reactivity Alerts · 4 Einträge

Strong Oxidizing Agent

Strong Oxidizing Agent

Explosive

Explosive

Reactivity Profile · 4 Einträge

The explosive instability of the lower dialkyl peroxides (e.g., dimethyl peroxide) and 1,1-bis-peroxides decreases rapidly with increasing chain length and degree of branching, the di-tert-alkyl derivatives being amongst the most stable class of peroxides. Though many 1,1-bis-peroxides have been reported, few have been purified because of the higher explosion hazards compared with the monofunctional peroxides. It is unlikely that this derivative would be particularly unstable compared to other peroxides in its class. [Bretherick 2nd ed., p 44 1979.]

The explosive instability of the lower dialkyl peroxides (e.g., dimethyl peroxide) and 1,1-bis-peroxides decreases rapidly with increasing chain length and degree of branching, the di-tert-alkyl derivatives being amongst the most stable class of peroxides. Though many 1,1-bis-peroxides have been reported, few have been purified because of the higher explosion hazards compared with the monofunctional peroxides. It is unlikely that this derivative would be particularly unstable compared to other peroxides in its class. [Bretherick 2nd ed., p 44 1979.]

The explosive instability of the lower dialkyl peroxides (e.g.,. dimethyl peroxide) and 1,1-bis-peroxides decreases rapidly with increasing chain length and degree of branching, the di-tert-alkyl derivatives being amongst the most stable class of peroxides. Though many 1,1-bis-peroxides have been reported, few have been purified because of the higher explosion hazards compared with the monofunctional peroxides. It is unlikely that this derivative would be particularly unstable compared to other peroxides in its class. [Bretherick 2nd ed., p 44 1979.]

The explosive instability of the lower dialkyl peroxides (e.g., dimethyl peroxide) and 1,1-bis-peroxides decreases rapidly with increasing chain length and degree of branching, the di-tert-alkyl derivatives being amongst the most stable class of peroxides. Though many 1,1-bis-peroxides have been reported, few have been purified because of the higher explosion hazards compared with the mono functional peroxides. It is unlikely that this derivative would be particularly unstable compared to other peroxides in its class. [Bretherick 2nd ed., p 44 1979.]

Air and Water Reactions · 4 Einträge

No rapid reaction with air. No rapid reaction with water.

No rapid reaction with air. No rapid reaction with water.

No rapid reaction with air. No rapid reaction with water.

No rapid reaction with air. No rapid reaction with water.

Hazard Classes and Categories · 2 Einträge

Org. Perox. C (74.7%)

Flammable liquids - Category 4

Sicherheit und Schutzausrüstung

Fire Fighting · 4 Einträge

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

First Aid · 4 Einträge

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Nonfire Spill Response · 4 Einträge

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Isolation and Evacuation · 4 Einträge

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Personal Protective Equipment (PPE) · 4 Einträge

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Excerpt from ERG Guide 146 [Organic Peroxides (Heat, Contamination and Friction Sensitive)]:

Sicherheitsdaten

wgk
2
tsca
TSCA listed
ridadr
UN 3103 5.2
hs_code
29096000
risk_code
7-62-50/53-36/37/38-61-65-45-51/53
hazard_code
O,N,T
safety_code
17-36/37/39-3/7-14A-61-60-45-26-14-53-62
hazard_class
5.2
packing_group
II
Speicherklasse
4.1A - Other explosive hazardous materials
Hazard Classifications
Asp. Tox. 1Carc. 1BEye Irrit. 2Muta. 1BOrg. Perox. CSkin Irrit. 2STOT SE 3