标识与物理属性
| CAS No. | 1193-65-3 |
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| 分子式 | C7H12ClNO |
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| 平均分子量 | 161.63 g/mol |
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| 单同位素质量 | 161.06074168 g/mol |
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| SMILES | Cl.O=C1CN2CCC1CC2 |
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| InChIKey | RFDPHKHXPMDJJD-UHFFFAOYSA-N |
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| PubChem CID | 102019 |
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| ChEMBL | CHEMBL554124 |
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| EC No. | 214-776-5 |
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| DTXSID | DTXSID4061599 |
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化学与物理性质
| 极性表面积 | 20.3 |
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| 氢键供体 | 1 |
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| 氢键受体 | 2 |
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| 可旋转键 | 0 |
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| 重原子 | 10 |
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| 形式电荷 | 0 |
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| 复杂度 | 136 |
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| 物质类别 | Nitrogen Compounds -> Other Nitrogen Compounds |
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| Physical Description | Off-white powder[Acros Organics MSDS] |
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安全与法规
| GHS 分类 | This chemical does not meet GHS hazard criteria for 2.8% (1 of 36) of reports.H411 (88.9%): Toxic to aquatic life with long lasting effects [Hazardous to the aquatic environment, long-term hazard]P273, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 36 reports by companies from 4 notifications to the ECHA C&L Inventory. |
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| 法规信息 | Status: Active Update: 29-05-2018 https://echa.europa.eu/registration-dossier/-/registered-dossier/20773 |
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| 危害概述 | May cause irritation[Acros Organics MSDS] |
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| Hazard Classes and Categories | Aquatic Chronic 2 (88.9%) |
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