CAS 13122-18-4 tert-Butyl peroxy-3,5,5-trimethylhexanoate (HCID 114465)

概要

This peroxide is sensitive to heat. Storage of this material must be done so with stringent temperature control measures.

名称と識別子

優先名称: tert-Butyl peroxy-3,5,5-trimethylhexanoate
IUPAC: tert-butyl 3,5,5-trimethylhexaneperoxoate
現地名: tert-ブチル(3,5,5-トリメチルヘキサノイル)ペルオキシド
英語名: tert-Butyl peroxy-3,5,5-trimethylhexanoate
分子式: C13H26O3
分子量: 230.34

名称と別名

tert-butyl 3,5,5-trimethylhexaneperoxoate13122-18-4tert-Butyl peroxy-3,5,5-trimethylhexanoatetert-Butyl 3,5,5-trimethylperoxyhexanoateHexaneperoxoic acid, 3,5,5-trimethyl-, 1,1-dimethylethyl ester84TC2IY818TRIGONOX 42PERBUTYL 355LUPEROX 270tert-butyl 3,5,5-trimethylhexanoylperoxideDTXSID40864365PEROXYHEXANOIC ACID, 3,5,5-TRIMETHYL-, TERT-BUTYL ESTER

名称をさらに表示

3,5,5-トリメチルヘキサンペルオキシ酸tert-ブチルtert-ブチルペルオキシ-3,5,5-トリメチルヘキサノアート3,5,5-トリメチルペルオキシヘキサン酸tert-ブチルtert-ブチル(3,5,5-トリメチルヘキサノイル)ペルオキシドtブチルパーオキシ3，5，5トリメチルヘキサノエートペルオキシ-3,5,5-トリメチルヘキサン酸TERT-ブチルt-ブチルパーオキシ-3,3,5-トリメチルヘキサノエート42strigonox®Perbutyl 355tert-Butylperisononanoatet-butyl 3,3,5-trimethylperoxyhexanoatet-Butyl peroxy-3,5,5-trimethyl hexanoate

TERT-BUTYL PEROXY-3,5,5-TRIMETHYLHEXANOATE, (TECHNICALLY PURE)TERT-BUTYL PEROXY-3,5,5-TRIMETHYLHEXANOATE, [TECHNICALLY PURE]trigonox 42sRefChem:896468tert-butyl peroxyisononanoateTRIGONOX 42-50PSDTXCID90812891236-050-7

データベース識別子

CAS: 13122-18-4
PubChem CID: 114465
DTXSID: DTXSID40864365
UNII: 84TC2IY818
EC Number: 236-050-7
Nikkaji: J4.395H

物性

構造計算による物性

XLogP: 4.1
極性表面積: 35.5 Å²
水素結合供与体数: 0
水素結合受容体数: 3
回転可能結合数: 7
重原子数: 16
形式電荷: 0
複雑度: 220

実験および物理化学的性質

Food Contact Substances · 2 件

FCS -> FDA Cumulative Estimated Daily Intake (CEDI)

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

Physical Description · 2 件

This peroxide is sensitive to heat. Storage of this material must be done so with stringent temperature control measures.

Other Solid; CBI; Liquid

物理化学的性質

融点: -30 °C · -30 °C
沸点: 312.34 °C · 312.34°C (rough estimate)
比重(密度): 0.897 · 0.897
蒸気圧: 3 Pa · 3Pa at 30.05℃
屈折率: 1.4295 · 1.4295-1.4315
貯蔵温度: Refrigerator (+4°C)
水溶解度: 一部混和性
InChI: InChI=1S/C13H26O3/c1-10(9-12(2,3)4)8-11(14)15-16-13(5,6)7/h10H,8-9H2,1-7H3
InChIKey: VSJBBIJIXZVVLQ-UHFFFAOYSA-N
SMILES: C(OOC(C)(C)C)(=O)CC(C)CC(C)(C)C
LogP: 4.4 at · 4.4 at 25℃
CAS データベース: 13122 · 13122-18-4
EPAの化学物質情報: 3 · Hexaneperoxoic acid, 3,5,5-trimethyl-, 1,1-dimethylethyl ester (13122-18-4)

化学的性質

化学的特性clear liquid

安全と法規制

GHS分類

GHS Classification · 5 件

This chemical does not meet GHS hazard criteria for 4% (5 of 125) of reports.

Danger

H242 (54.4%): 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)

Aggregated GHS information provided per 125 reports by companies from 9 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.

危険有害性情報

Regulatory Information · 4 件

Chemical: Hexaneperoxoic acid, 3,5,5-trimethyl-, 1,1-dimethylethyl ester

Hexaneperoxoic acid, 3,5,5-trimethyl-, 1,1-dimethylethyl ester is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Hexaneperoxoic acid, 3,5,5-trimethyl-, 1,1-dimethylethyl ester 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: 11-04-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/14600

Hexaneperoxoic acid, 3,5,5-trimethyl-, 1,1-dimethylethyl ester: Does not have an individual approval but may be used under an appropriate group standard

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

安全と保護具

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)]:

安全データ

tsca: TSCA listed
ridadr: UN 2104
hs_code: 29159000
risk_code: 7-38
hazard_code: Xi-O,Xi,O
safety_code: 36/37/39-3/7-26-14A

化学と産業

用途と製造

U.S. Production2023: 550,000 - <1,000,000 lb

Consumer UsesNot Known or Reasonably Ascertainable

Industry UsesCBI

General Manufacturing Information · 2 件

CBI

Hexaneperoxoic acid, 3,5,5-trimethyl-, 1,1-dimethylethyl ester: ACTIVE

応用分野 · 2 件

使用Tert-butyl peroxy-3,5,5-trimethylhexanoate is a clear liquid which has C13H26O3 as chemical formula. It is used as initiator in the production of acrylic polymers, polyethylene and styrene. Further it is applied as curing agent in the production of unsaturated polyester resins.

一般的な説明This peroxide is sensitive to heat. Storage of tert-Butyl peroxy-3,5,5-trimethylhexanoate must be done so with stringent temperature control measures.

サプライヤー36 社

Hebei Chuanghai Biotechnology Co., Ltd+86-17732866630 · [email protected]

广州纳珑化工有限公司13192879270; 13192879270 · [email protected]

湖北成丰化工有限公司13125175253 · [email protected]

Baoji Guokang Healthchem co.,ltd+8615604608665 15604608665 · [email protected]

Dayang Chem (Hangzhou) Co.,Ltd.+86-0571-88938639 17705817739 · [email protected]

化合物ノート

読み込み中…

tert-ブチル(3,5,5-トリメチルヘキサノイル)ペルオキシド

基本情報

概要