化工社化工社 化学情報印刷レポート · 研究参考用
HCID 80604作成日：2026年10月27日
trans-4-メチルシクロヘキシルアミン
trans-4-メチルシクロヘキシルアミン · TRANS-4-METHYLCYCLOHEXYLAMINE · Trans- · Trans-4-MethylcyclohexanaMine · Glimepiride Impurity 24 · Trans-4-Methylcylohexylamine · rans-4-Methylcyclohexylamine · trans-4-Methylcyclohexylamin
https://huagongshe.com/ja/chemical/80604
識別子と物理属性
| CAS No. | 2523-55-9 |
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| 分子式 | C7H15N |
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| 平均分子量 | 113.2 g/mol |
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| 単同位体質量 | 113.12044948 g/mol |
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| SMILES | CC1CCC(N)CC1 |
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| InChIKey | KSMVBYPXNKCPAJ-UHFFFAOYSA-N |
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| PubChem CID | 80604 |
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| ChEMBL | CHEMBL3780789 |
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| ChEBI | CHEBI:183280 |
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| EC No. | 228-673-8 |
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| DTXSID | DTXSID2064232 |
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| 現地名 | trans-4-メチルシクロヘキシルアミン |
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化学・物理的性質
| XLogP | 1.5 |
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| 極性表面積 | 26 |
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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 | 8 |
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| 形式電荷 | 0 |
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| 複雑度 | 62.8 |
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| Physical Description | P-aminocyclohexylmethane appears as a colorless viscous oily liquid with almost no odor. Contact with the skin, eyes and mucous membranes causes severe chemical burns. Toxic by skin absorption. Toxic ammonia and nitrogen oxides may be released upon exposure to fire. |
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| 融点 | -8.5°C (estimate) |
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| 沸点 | 151-154°C |
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| 密度 | 0.85 |
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| 屈折率 | 1.4500 to 1.4530 |
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| 引火点 | 26°C |
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| 貯蔵条件 | Keep in dark place,Inert atmosphere,Room temperature |
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| 溶解度 | DMSO (Slightly), Methanol (Slightly) |
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| 外観・状態 | clear liquid |
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| pKa（酸解離定数） | 10.58±0.70(Predicted) |
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| 色 | Colorless to Light yellow |
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| InChI | InChI=1S/C7H15N/c1-6-2-4-7(8)5-3-6/h6-7H,2-5,8H2,1H3/t6-,7- |
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| InChIKey | KSMVBYPXNKCPAJ-LJGSYFOKSA-N |
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| SMILES | [C@@H]1(N)CC[C@@H](C)CC1 |
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| CAS データベース | 2523-55-9(CAS DataBase Reference) |
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安全性と法規制
| GHS 分類 | DangerH226 (100%): Flammable liquid and vapor [Warning Flammable liquids]P210, P233, P240, P241, P242, P243, P260, P264, P280, P301+P330+P331, P302+P361+P354, P303+P361+P353, P304+P340, P305+P354+P338, P316, P321, P363, P370+P378, P403+P235, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 40 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
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| 輸送ラベル（DOT） | Corrosive |
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| 火災危険 | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
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| 健康有害性 | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
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| 反応性グループ | Amines, Phosphines, and Pyridines |
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| Reactivity Profile | P-AMINOCYCLOHEXYLMETHANE is incompatible with acids and oxidizing agents. Neutralizes acids exothermically to form salts plus water. May be incompatible with isocyanates, halogenated organics, peroxides, phenols (acidic), epoxides, anhydrides, and acid halides. Generates flammable gaseous hydrogen in combination with strong reducing agents, such as hydrides. |
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| Air and Water Reactions | Slowly decomposes in air to yield ammonia. |
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| Hazard Classes and Categories | Flam. Liq. 3 (100%) |
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| 消火 | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
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| 応急処置 | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
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| 非火災時の漏出対応 | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
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| Isolation and Evacuation | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
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| Personal Protective Equipment (PPE) | Excerpt from ERG Guide 154 [Substances - Toxic and/or Corrosive (Non-Combustible)]: |
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| 輸送番号（UN） | 2733 |
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