기본 정보
- 표준 SMILES
CC(C)(CCC(C)(C)OOC(=O)c1ccccc1)OOC(=O)c1ccccc1- InChIKey
RIPYNJLMMFGZSX-UHFFFAOYSA-N- 분자식
- C22H26O6
- 평균 분자량
- 386.4 g/mol
- 단동위원소 질량
- 386.17293855
개요
This solid peroxide is particularly sensitive to temperature rises and contamination. Above a given "Control Temperature" they decompose violently. It is generally stored or transported as a mixture, with an inert solid.
이름 및 식별자
- 우선 이름
- 2,5-Dimethyl-2,5-DI-(benzoylperoxy)hexane
- IUPAC
- (5-benzoylperoxy-2,5-dimethylhexan-2-yl) benzenecarboperoxoate
- 현지명
- 2.5-디메틸-2.5-비스(벤조일퍼옥시)헥산
- 영어명
- 2,5-Dimethyl-2,5-di(benzoylperoxy)hexane
- 분자식
- C22H26O6
- 분자량
- 386.44
이름 및 동의어
이름 더 보기
데이터베이스 식별자
- CAS
2618-77-1- PubChem CID
- 75796
- DTXSID
DTXSID5062556- UNII
- A5SRX84PEA
- EC Number
- 220-050-9
- Nikkaji
- J5.176D
물성
구조 계산 물성
- XLogP
- 5.4
- 극성 표면적
- 71.1 Ų
- 수소 결합 공여자 수
- 0
- 수소 결합 수용자 수
- 6
- 회전 가능 결합 수
- 11
- 무거운 원자 수
- 28
- 형식 전하
- 0
- 복잡도
- 455
실험 및 물리화학적 성질
물리화학적 성질
- 끓는 점
- 529.9 · 529.9±33.0 °C(Predicted)
- 밀도
- 1.143 · 1.143±0.06 g/cm3(Predicted)
- EPA
- 1 · Benzenecarboperoxoic acid, 1,1'-(1,1,4,4-tetramethyl-1,4-butanediyl) ester (2618-77-1)
안전 및 규제
GHS 분류
GHS Classification
Danger
H241: Heating may cause a fire or explosion [Danger Self-reactive substances and mixtures; Organic peroxides]
P210, P234, P235, P240, P280, P370+P380+P375[+P378], P403, P410, P411, P420, and P501 (click each P-code to see the statement)
유해성 정보
Reactivity Profile
Peroxides, such as 2,5-DIMETHYL-2,5-DI-(BENZOYLPEROXY)HEXANE, 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. Danger of explosion when dry. May explode from heat or contamination. May ignite combustibles (wood, paper, oil, clothing, etc.). May be ignited by heat, sparks or flames.
안전 및 보호
안전 데이터
- tsca
- TSCA listed
- ridadr
- 3102
- 포장분류
- II
- 위험 등급
- 5.2
화학 및 산업
용도 및 제조
응용 분야
일반 설명2,5-DIMETHYL-2,5-DI(BENZOYLPEROXY)HEXANE is particularly sensitive to temperature rises and contamination. Above a given "Control Temperature" they decompose violently. 2,5-DIMETHYL-2,5-DI(BENZOYLPEROXY)HEXANE is generally stored or transported as a mixture, with an inert solid.
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