識別子と物理属性
| CAS No. | 1643-19-2 |
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| 分子式 | C16H36N.Br |
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| 平均分子量 | 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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化学・物理的性質
| 極性表面積 | 0 |
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| 水素結合供与体数 | 0 |
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| 水素結合受容体数 | 1 |
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| 回転可能結合数 | 12 |
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| 重原子数 | 18 |
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| 形式電荷 | 0 |
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| 複雑度 | 116 |
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| 物質分類 | Nitrogen Compounds -> Quaternary Amines |
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| 化粧品 | AntimicrobialAntistatic |
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| Physical Description | LiquidDry PowderHygroscopic solid[Sigma-Aldrich MSDS] |
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安全性と法規制
| GHS 分類 | 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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| 規制情報 | 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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| その他の安全情報 | IMAP assessments - Tetrabutylammonium salts: Human health tier II assessment |
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| 有害性の概要 | 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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