化工社化工社 化学情報印刷レポート · 研究参考用
HCID 568323作成日：2026年11月1日
Methyl 8-bromocubane-1-carboxylate
methyl 4-bromocubane-1-carboxylate · Methyl 8-bromocubane-1-carboxylate · Methyl (1S,2R,3R,8S)-4-bromocubane-1-carboxylate · (1R,2R,3R,4S,5R,6S,7S,8S)-methyl 4-bromocubane-1-carboxylate · Methyl 4-bromopentacyclo[4.2.0.02,5.03,8.04,7]octane-1-carboxylate · Pentacyclo[4.2.0.02,5.03,8.04,7]octane-1-carboxylic acid, 4-bromo-, methyl ester
https://huagongshe.com/ja/chemical/568323
識別子と物理属性
| CAS No. | 37794-28-8 |
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| 分子式 | C10H9BrO2 |
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| 平均分子量 | 241.08 g/mol |
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| 単同位体質量 | 239.97859 g/mol |
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| SMILES | COC(=O)C12C3C4C1C1C2C3C41Br |
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| InChIKey | AYRUWJVGHGZOKB-UHFFFAOYSA-N |
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| PubChem CID | 568323 |
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| EC No. | 959-508-4 |
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化学・物理的性質
| XLogP | 1 |
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| 極性表面積 | 26.3 |
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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 | 2 |
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| 回転可能結合数 | 2 |
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| 重原子数 | 13 |
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| 形式電荷 | 0 |
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| 複雑度 | 329 |
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| 沸点 | 263.9±40.0 °C(Predicted) |
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| 密度 | 2.242±0.06 g/cm3(Predicted) |
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| 貯蔵条件 | Store at 0-8 °C |
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安全性と法規制
| GHS 分類 | WarningH315 (100%): 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 2 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 | Skin Irrit. 2 (100%) |
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| 税関コード | 2916200090 |
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