Huagongshe화공사 화학 정보 인쇄 보고서 · 연구 참고용
1,1,3,3-테트라메틸뷰틸 히드로과산화물
1,1,3,3-테트라메틸부틸하이드로퍼옥사이드 · 1,1,3,3-테트라메틸뷰틸히드로과산화물 · 1,1,3,3-테트라메틸뷰틸히드로과산화물(1,1,3,3-TETRAMETHYLBUTYLHYDROPEROXI... · 1,1,3,3-테트라메틸부틸하이드로페록사이드 · Einecs 227-369-2 · 1,1,3,3-Tetramethylbutyl hydroperoxide · 2-(Hydroperoxy)-2,4,4-trimethylpentane · 1,1,3,3-tetramethylbutyl hydropereoxide
식별자 및 물리적 특성
| CAS No. | 5809-08-5 |
|---|---|
| 분자식 | C8H18O2 |
| 평균 분자량 | 146.23 g/mol |
| 단동위원소 질량 | 146.13067982 g/mol |
| SMILES | CC(C)(C)CC(C)(C)OO |
| InChIKey | MIRQGKQPLPBZQM-UHFFFAOYSA-N |
| PubChem CID | 79877 |
| EC No. | 227-369-2 |
| DTXSID | DTXSID3064011 |
| 현지명 | 1,1,3,3-테트라메틸뷰틸 히드로과산화물 |
화학 및 물리적 성질
| XLogP | 2.3 |
|---|---|
| 극성 표면적 | 29.5 |
| 수소 결합 공여자 수 | 1 |
| 수소 결합 수용자 수 | 2 |
| 회전 가능 결합 수 | 3 |
| 무거운 원자 수 | 10 |
| 형식 전하 | 0 |
| 복잡도 | 100 |
| Physical Description | This liquid peroxide is heat and contamination sensitive. |
| 끓는 점 | 197.7±9.0 °C(Predicted) |
| 밀도 | 0.888±0.06 g/cm3(Predicted) |
| 증기압 | 15Pa at 20℃ |
| pKa(산도 계수) | 12.71±0.50(Predicted) |
| 용해도 | 2.8g/L at 20℃ |
| LogP(분배 계수) | 2.9 at 20℃ |
| EPA | Hydroperoxide, 1,1,3,3-tetramethylbutyl (5809-08-5) |
안전 및 규제
| GHS 분류 | DangerH226 (65%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P234, P235, P240, P241, P242, P243, P260, P261, P264, P264+P265, P270, P271, P272, P273, P280, P301+P317, P301+P330+P331, P302+P352, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P317, P321, P330, P332+P317, P333+P317, P362+P364, P363, P370+P378, P391, P403, P403+P233, P403+P235, P405, P410, P411, P420, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 20 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 규제 정보 | Status: Active Update: 05-08-2019 https://echa.europa.eu/registration-dossier/-/registered-dossier/10047 |
| 운송 라벨(DOT) | Organic Peroxide |
| 화재 위험 | Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]: |
| 건강 유해성 | Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]: |
| 반응성 그룹 | Peroxides, Organic |
| Reactivity Alerts | Explosive |
| Reactivity Profile | Most alkyl monohydroperoxides are liquid, the explosivity of the lower members (e.g., methyl hydroperoxide, or possibly due to traces of the dialkyl peroxides) decreasing with increasing chain length and branching [Bretherick 2nd ed. 1979 p.10]. |
| Air and Water Reactions | No rapid reaction with air. No rapid reaction with water. |
| Hazard Classes and Categories | Flam. Liq. 3 (65%) |
| 소화 | Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]: |
| 응급 처치 | Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]: |
| 비화재 누출 대응 | Excerpt from ERG Guide 145 [Organic Peroxides (Heat and Contamination Sensitive)]: |
| Isolation and Evacuation | Excerpt 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)]: |
| TSCA 등재 상태 | TSCA listed |
| 운송 번호(UN) | 3105 |
| 포장분류 | II |
| 위험 등급 | 5.2 |
| 기존화학 물질 | 2002-3-2170 |
용도
일반 설명
1,1,3,3-Tetramethylbutyl hydroperoxide is heat and contamination sensitive.