Identifiers & Physical Properties
| CAS No. | 33884-43-4 |
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| Molecular formula | C6H11BrO2 |
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| Average molar mass | 195.05 g/mol |
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| Monoisotopic mass | 193.99424169 g/mol |
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| SMILES | BrCCC1OCCCO1 |
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| InChIKey | WMDHQEHPOVOEOG-UHFFFAOYSA-N |
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| PubChem CID | 520656 |
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| EC No. | 251-716-7 |
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| DTXSID | DTXSID10885567 |
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Chemical & Physical Properties
| XLogP | 1.3 |
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| Topological polar surface area | 18.5 |
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| Hydrogen bond donors | 0 |
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| Hydrogen bond acceptors | 2 |
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| Rotatable bonds | 2 |
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| Heavy atoms | 9 |
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| Formal charge | 0 |
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| Complexity | 71.5 |
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| Chemical classes | Other Classes -> Halogenated Ethers |
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| Physical Description | Colorless liquid[Alfa Aesar MSDS] |
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Safety & Regulations
| GHS classification | This chemical does not meet GHS hazard criteria for 2.1% (1 of 47) of reports.WarningH315 (97.9%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P351+P338, P319, P321, P332+P317, P337+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 47 reports by companies from 7 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Regulatory information | PMN - indicates a commenced PMN (Pre-Manufacture Notices) substance. |
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| Hazards summary | A skin and strong eye irritant[Alfa Aesar MSDS] See 2-(3-Bromophenyl)-1,3-dioxolane. See 4,4-Dimethyl-1,3-dioxane. See 2,3-Dichloro-1,4-dioxane. See 1,3-Dioxane. |
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| Hazard Classes and Categories | Skin Irrit. 2 (97.9%) |
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