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1,1-ビス(1,1-ジメチルエチルペルオキシ)シクロヘキサン

1,1-Bis(tert-butylperoxy)cyclohexane

HCID 76359
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印刷プレビュー
基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
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基本情報

CAS
3006-86-8
標準SMILES
CC(C)(C)OOC1(OOC(C)(C)C)CCCCC1
InChIKey
HSLFISVKRDQEBY-UHFFFAOYSA-N
分子式
C14H28O4
平均分子量
260.37 g/mol
単同位体質量
260.19875938

概要

Organic solvent solution, added to lessen explosion hazard.

名称と識別子

優先名称
1,1-Bis(tert-butylperoxy)cyclohexane
IUPAC
1,1-bis(tert-butylperoxy)cyclohexane
現地名
1,1-ビス(1,1-ジメチルエチルペルオキシ)シクロヘキサン
英語名
1,1-Di(tert-butylperoxy)cyclohexane
分子式
C14H28O4
分子量
260.37

名称と別名

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
名称をさらに表示
1,1-ビス(tert-ブチルペルオキシ)シクロヘキサン1,1-ビス(1,1-ジメチルエチルペルオキシ)シクロヘキサン1,1-ビス(tert-ブチルジオキシ)シクロヘキサンペルヘキサC1,1-ジ(TERT-ブチルペルオキシ)シクロヘキサン,50%ミネラルオイル溶液ジtertブチル=シクロヘキシリデン=ジペルオキシド1,1-ビス(t-ブチルパーオキシ)シクロヘキサン1,1-ビス(ターシャリ-ブチルパーオキシ)シクロヘキサン1,1‐ジ(TERT‐ブチルペルオキシ)シクロヘキサン,50%ミネラルオイル溶液LUPEROX® 331M80、1,1-ビス(TERT-ブチルペルオキシ)シクロヘキサン 溶液1,1-ジ(tert-ブチルペルオキシ)シクロヘキサン1,1-bis(T-butylperoxy)cyclohexaneDP275BPerhexa-CChaloxyd PTrigonox 22Lupersol 331TRIGONOX(R) 22Luperox? 331P80
PEROXAN PK 122WTRIGONOX 22C50TRIGONOX 22E50TRIGONOX 22E70LUPEROX 331DTXSID4044907TX 22E50Cyclohexylidenebis[tert-butyl] peroxide

データベース識別子

CAS
3006-86-8
PubChem CID
76359
DTXSID
DTXSID4044907
UNII
JK62J3E3Q4
EC Number
221-111-2
Nikkaji
J4.394J

物性

構造計算による物性

XLogP
3.7
極性表面積
36.9 Ų
水素結合供与体数
0
水素結合受容体数
4
回転可能結合数
6
重原子数
18
形式電荷
0
複雑度
224

実験および物理化学的性質

Physical Description · 3 件

Organic solvent solution, added to lessen explosion hazard.

Particularly heat and contamination sensitive.

CBI; Liquid

物理化学的性質

融点
65 °C · 65 °C (SADT)
沸点
52 · 52-54 °C (0.1 mmHg)
比重(密度)
0.891 g/mL · 0.891 g/mL at 25 °C
蒸気圧
4.88 hPa · 4.88hPa at 25℃
屈折率
20 · n20/D 1.435
闪点
155 °F · 155 °F
貯蔵温度
2 · 2-8°C
外見
液体
色
クリア
水溶解度
混和性
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
InChIKey
HSLFISVKRDQEBY-UHFFFAOYSA-N
SMILES
C1(CCCCC1)(OOC(C)(C)C)OOC(C)(C)C
LogP
7.2 at · 7.2 at 25℃
CAS データベース
3006 · 3006-86-8(CAS DataBase Reference)

安全と法規制

安全情報は参考情報です。供給元の安全データシート(SDS)、適用法令、専門家による評価に代わるものではありません。

GHS分類

GHS Classification · 6 件

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

危険有害性情報

Regulatory Information · 4 件

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 件

Organic Peroxide

Organic Peroxide

Organic Peroxide

Organic Peroxide Explosive

Fire Hazards · 4 件

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)]:

化学と産業

用途と製造

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

Plastics Material and Resin Manufacturing

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

応用分野

用途ラジカル重合開始剤,不飽和ポリエステル硬化剤

使用Polymerization initiator.

補足説明

定義1,1-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].

関連反応

6 件
反応記録を作成
HRID 463539 の反応式
HRID 463539反応物としてuspto-grants-1985_05
HRID 568758 の反応式
HRID 568758反応物としてuspto-grants-1988_03
HRID 1649570 の反応式
HRID 1649570反応物としてuspto-grants-1983_11
HRID 1654593 の反応式
HRID 1654593反応物としてuspto-grants-1995_04
HRID 1680667 の反応式
HRID 1680667反応物としてuspto-grants-1981_06
HRID 1902737 の反応式
HRID 1902737反応物としてuspto-grants-1982_12

化合物ノート

読み込み中…

このページの内容基本情報概要名称と識別子物性安全と法規制化学と産業関連反応化合物ノート
その他の操作
ノートを作成反応を作成見積依頼を出す
EPAの化学物質情報
1 · Peroxide, 1,1'-cyclohexylidenebis[2-(1,1-dimethylethyl) (3006-86-8)

化学的性質

化学的特性clear liquid

Health Hazards · 4 件

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 件

Peroxides, Organic

Peroxides, Organic

Peroxides, Organic

Peroxides, Organic

Reactivity Alerts · 4 件

Strong Oxidizing Agent

Strong Oxidizing Agent

Explosive

Explosive

Reactivity Profile · 4 件

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 件

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 件

Org. Perox. C (74.7%)

Flammable liquids - Category 4

安全と保護具

Fire Fighting · 4 件

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 件

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 件

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 件

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 件

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)]:

安全データ

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
消防法
危-5-PO-2-II
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
Hazard Classifications
Asp. Tox. 1Carc. 1BEye Irrit. 2Muta. 1BOrg. Perox. CSkin Irrit. 2STOT SE 3
ストレージクラス
4.1A - Other explosive hazardous materials