2,5-ジメチルー2,5-ビス(t-ブチルパーオキシ)ヘキサン

2,5-Dimethyl-2,5-di-(tert-butylperoxy)hexane

HCID 6545CAS 78-63-7

基本情報

標準SMILES
CC(C)(C)OOC(C)(C)CCC(C)(C)OOC(C)(C)C
InChIKey
DMWVYCCGCQPJEA-UHFFFAOYSA-N
分子式
C16H34O4
平均分子量
290.44 g/mol
単同位体質量
290.24570957

概要

2,5-dimethyl-2,5-di-(tert-butylperoxy)hexane, [<= 52% with inert solid] is a clear, yellow liquid. (NTP, 1992)also for storage and transport mixed with inert solid.

名称と識別子

優先名称
2,5-Dimethyl-2,5-di-(tert-butylperoxy)hexane
IUPAC
2,5-bis(tert-butylperoxy)-2,5-dimethylhexane
現地名
2,5-ジメチルー2,5-ビス(t-ブチルパーオキシ)ヘキサン
英語名
2,5-Dimethyl-2,5-di(tert-butylperoxy)hexane
分子式
C16H34O4
分子量
290.44

名称と別名

78-63-72,5-Dimethyl-2,5-di(tert-butylperoxy)hexane2,5-Dimethyl-2,5-di-(tert-butylperoxy)hexaneVaroxPerhexa 3M40Trigonox 101-101/45CCRIS 4626DTXSID9025110EINECS 201-128-1NSC 38203BRN 1863369UNII-923755EYY5
名称をさらに表示
2,5-ジメチル-2,5-ビス(t-ブチルパ-オキシ)ヘキサン2,5-ジメチルー2,5-ビス(t-ブチルパーオキシ)ヘキサン2,5ジメチル2,5ジ(tブチルペルオキシ)ヘキサン2,5-ジメチル-2,5-ジ(tert-ブチルペルオキシ)ヘキサン2,5-ジメチル-2,5-ビス(T-ブチルパーオキシ)ヘキサンLUPEROX® 101, 2,5-BIS(TERT-ブチルペルオキシ)-2,5-ジメチルヘキサンLUPEROX® 101XL, 2,5-BIS(TERT-ブチルペルオキシ)-2,5-ジメチルヘキサン、 炭酸カリシウムおよびケイ素混合物luperoxTrigonox 101DPDHluperox1012,5-Dimethyl-2,5-di2,5-Dimethyl-2,5-di(tert-butyl2,5-DIMETHYL-2,5-DI(T-BUTYL-PEROXY)HEXANE2,5-BIS(TERT-BUTYLPEROXY)-2,5-DIMETHYLHEXANE2,5-DIMETHYL-2,5-BIS(TERT-BUTYLPEROXY)HEXANE2,5-Bis(tert-butyl peroxide)-2,5-dimethyhexane
VAROX DBPHNSC-38203Hexane, 2,5-dimethyl-2,5-di(tert-butylperoxy)-923755EYY52,5-Dimethyl-2,5-bis(tert-butylhydroperoxy)hexaneDTXCID005110EC 201-128-1Peroxide, (1,1,4,4-tetramethyl-1,4-butanediyl)bis((1,1-dimethylethyl)

データベース識別子

CAS
78-63-7
PubChem CID
6545
DTXSID
DTXSID9025110
ChEMBL
CHEMBL1874231
UNII
923755EYY5
EC Number
201-128-1
Nikkaji
J2.829K

物性

構造計算による物性

XLogP
3.9
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
9
重原子数
20

実験および物理化学的性質

Chemical Classes · 2 件

Other Classes -> Peroxides, Organic

Industrial compound

Solubilityless than 1 mg/mL at 73 °F (NTP, 1992)
Flash Point185 °F (NTP, 1992)
Boiling Point122 to 126 °F at 0.1 mmHg (NTP, 1992)
Melting Point46 °F (NTP, 1992)
Food Contact Substances · 3 件

FCS -> FDA Cumulative Estimated Daily Intake (CEDI)

FCS -> FDA Inventory of Food Contact Substances Listed in 21 CFR

FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications

物理化学的性質

融点
6 °C · 6 °C
沸点
55 · 55-57 °C7 mm Hg(lit.)
比重(密度)
0.877 g/mL · 0.877 g/mL at 25 °C(lit.)
蒸気圧
0.002 Pa · 0.002Pa at 20℃
屈折率
20 · n20/D 1.423(lit.)
闪点
149 °F · 149 °F

化学的性質

化学的特性colourless to light yellow liquid

安全と法規制

GHS分類

GHS Classification · 6 件

Danger

H226 (11.8%): Flammable liquid and vapor [Warning Flammable liquids]

P210, P233, P234, P235, P240, P241, P242, P243, P264, P264+P265, P273, P280, P302+P352, P303+P361+P353, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364, P370+P378, P403, P403+P235, P410, P411, P420, and P501 (click each P-code to see the statement)

Aggregated GHS information provided per 524 reports by companies from 16 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

Danger

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

危険有害性情報

Regulatory Information · 5 件

Chemical: Peroxide, (1,1,4,4-tetramethyl-1,4-butanediyl)bis[(1,1-dimethylethyl)

Hazard Traits - Bioaccumulation; Environmental Persistence

Peroxide, 1,1'-(1,1,4,4-tetramethyl-1,4-butanediyl)bis[2-(1,1-dimethylethyl) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Peroxide, 1,1'-(1,1,4,4-tetramethyl-1,4-butanediyl)bis[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: 30-03-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/14360

Peroxide, (1,1,4,4-tetramethyl-1,4-butanediyl)bis[(1,1-dimethylethyl) 100%: Does not have an individual approval but may be used under an appropriate group standard

Other Safety InformationIMAP assessments - Peroxide, (1,1,4,4-tetramethyl-1,4-butanediyl)bis[(1,1-dimethylethyl): Human health tier I assessment
DOT Label · 2 件

Organic Peroxide

Organic Peroxide

Fire Hazards · 2 件

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

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

Health Hazards · 2 件

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

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

Hazards Summary · 1 件

Increased liver weights with corresponding hepatocellular hypertrophy observed in 7-day oral study of rats; [EPA - TSCATS] A strong oxidizing agent that can ignite combustible materials; May explode if heated or contaminated; [CAMEO] A skin and eye irritant; [NTP] May explode from shock, friction, or heat; A skin irritant; [ECHA REACH Registrations] An unstable oxidizer that may cause fire; An irritant; [Sigma-Aldrich MSDS] See 1,4-Bis(alpha-(t-butyldioxy)isopropyl)benzene, Di-tert-butyl peroxide, and Methyl ethyl ketone peroxide.

安全と保護具

Fire Fighting · 2 件

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

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

First Aid · 2 件

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

EYES: First check the victim for contact lenses and remove if present. Flush victim's eyes with water or normal saline solution for 20 to 30 minutes while simultaneously calling a hospital or poison control center. Do not put any ointments, oils, or medication in the victim's eyes without specific instructions from a physician. IMMEDIATELY transport the victim after flushing eyes to a hospital even if no symptoms (such as redness or irritation) develop.

Nonfire Spill Response · 2 件

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

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

Isolation and Evacuation · 2 件

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

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

Personal Protective Equipment (PPE) · 2 件

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

RECOMMENDED RESPIRATOR: Where the neat test chemical is weighed and diluted, wear a NIOSH-approved half face respirator equipped with an organic vapor/acid gas cartridge (specific for organic vapors, HCl, acid gas and SO2) with a dust/mist filter. (NTP, 1992)

毒性情報

Adverse EffectsOccupational hepatotoxin - Secondary hepatotoxins: the potential for toxic effect in the occupational setting is based on cases of poisoning by human ingestion or animal experimentation.

安全データ

wgk
1
tsca
TSCA listed
rtecs
MO1835000
ridadr
UN 3108 5.2
hs_code
29012990
risk_code
8-36/37/38-7-36/38-10-41-37/38-68-38-2

化学と産業

用途と製造

Uses · 2 件

Used to vulcanize or cross-link elastomers and polyolefins; [EPA - TSCATS] Used as a polymer additive, crosslinking agent, for curing resins, and to make belting, rubber and plastic hose, other rubber products, and plastics; [Government of Canada: Screening Assessment]

Plastic Composites Manufacturing [Category: Industry]

U.S. Production2023: 2,500,000 - <4,000,000 lb
Consumer UsesNot Known or Reasonably Ascertainable
Industry UsesPlasticizer
General Manufacturing Information · 2 件

Plastics Product Manufacturing

Peroxide, 1,1'-(1,1,4,4-tetramethyl-1,4-butanediyl)bis[2-(1,1-dimethylethyl): ACTIVE

応用分野

用途有機過酸化物(重合触媒)原料、架橋剤(合成ゴム、ポリエチレン)、PPの解重号剤(MFI改良剤)

一般的な説明2,5-Dimethyl-2,5-di(tert-butylperoxy)hexane, also known as trigonox 101, is a clear, yellow liquid. (NTP, 1992)also for storage and transport mixed with inert solid.

サプライヤー50 社

阿诺西(上海)生物技术有限公司400-1107768 15058188853 · [email protected]
上海阿拉丁生化科技股份有限公司400-6206333 13167063860 · [email protected]
上海策嵘生物科技有限公司[email protected]
上海莉凯化工技术有限公司16628776521 · [email protected]
广州纳珑化工有限公司13192879270; 13192879270 · [email protected]

関連反応

9 件

関連ノート

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