識別子と物理属性
| CAS No. | 33711-43-2 |
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| 分子式 | C14H24O |
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| 平均分子量 | 208.34 g/mol |
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| 単同位体質量 | 208.18271539 g/mol |
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| SMILES | CC1C(C)(C)C2=C(C(O)CCC2)C1(C)C |
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| InChIKey | TYCUOMHJQBSOBZ-UHFFFAOYSA-N |
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| PubChem CID | 14817841 |
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| EC No. | 801-670-4 |
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| DTXSID | DTXSID00564374 |
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化学・物理的性質
| XLogP | 2.9 |
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| 極性表面積 | 20.2 |
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| 水素結合供与体数 | 1 |
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| 水素結合受容体数 | 1 |
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| 回転可能結合数 | 0 |
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| 重原子数 | 15 |
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| 形式電荷 | 0 |
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| 複雑度 | 309 |
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安全性と法規制
| GHS 分類 | WarningH373 (100%): May causes damage to organs through prolonged or repeated exposure [Warning Specific target organ toxicity, repeated exposure]P260, P273, P319, P391, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 11 reports by companies from 1 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| Hazard Classes and Categories | STOT RE 2 (100%) |
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