식별자 및 물리적 특성
| CAS No. | 1643-19-2 |
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| 분자식 | C16H36N.Br |
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| 평균 분자량 | 322.37 g/mol |
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| SMILES | CCCC[N+](CCCC)(CCCC)CCCC.[Br-] |
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| InChIKey | JRMUNVKIHCOMHV-UHFFFAOYSA-M |
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| PubChem CID | 74236 |
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| ChEMBL | CHEMBL60696 |
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| ChEBI | CHEBI:51993 |
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| EC No. | 216-699-2 |
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| DTXSID | DTXSID4044400 |
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화학 및 물리적 성질
| 극성 표면적 | 0 |
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| 수소 결합 공여자 수 | 0 |
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| 수소 결합 수용자 수 | 1 |
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| 회전 가능 결합 수 | 12 |
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| 무거운 원자 수 | 18 |
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| 형식 전하 | 0 |
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| 복잡도 | 116 |
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| 물질 분류 | Nitrogen Compounds -> Quaternary Amines |
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| 화장품 | AntimicrobialAntistatic |
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| Physical Description | LiquidDry PowderHygroscopic solid[Sigma-Aldrich MSDS] |
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안전 및 규제
| GHS 분류 | This chemical does not meet GHS hazard criteria for 13.7% (70 of 511) of reports.WarningH302 (43.2%): Harmful if swallowed [Warning Acute toxicity, oral]P203, P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P318, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 511 reports by companies from 35 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| 규제 정보 | Chemical: 1-Butanaminium, N,N,N-tributyl-, bromide1-Butanaminium, N,N,N-tributyl-, bromide (1:1) is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of 1-Butanaminium, N,N,N-tributyl-, bromide (1:1) 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: 31-01-2023 https://echa.europa.eu/registration-dossier/-/registered-dossier/15982Tetrabutylammonium bromide: Does not have an individual approval but may be used under an appropriate group standard |
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| 기타 안전 정보 | IMAP assessments - Tetrabutylammonium salts: Human health tier II assessment |
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| 유해성 요약 | A skin and strong eye irritant[Sigma-Aldrich MSDS] |
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| Hazard Classes and Categories | Acute Tox. 4 (43.2%)Acute toxicity (ingestion) - category 4 |
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| Protective Action Criteria (PAC) | 12 [mg/m3]130 [mg/m3]790 [mg/m3] |
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