化工社化工社 化学情報印刷レポート · 研究参考用
5-Methyl-1-hexanol
isoheptan-1-ol · Einecs 257-413-6
識別子と物理属性
| CAS No. | 51774-11-9 |
|---|---|
| 分子式 | C7H16O |
| 平均分子量 | 116.2 g/mol |
| 単同位体質量 | 116.12011513 g/mol |
| SMILES | CC(C)CCCCO |
| InChIKey | ZVHAANQOQZVVFD-UHFFFAOYSA-N |
| PubChem CID | 12331 |
| EC No. | 211-023-2 |
| DTXSID | DTXSID501031584 |
化学・物理的性質
| XLogP | 2.1 |
|---|---|
| 極性表面積 | 20.2 |
| 水素結合供与体数 | 1 |
| 水素結合受容体数 | 1 |
| 回転可能結合数 | 4 |
| 重原子数 | 8 |
| 形式電荷 | 0 |
| 複雑度 | 41.7 |
| SpringerMaterials Properties | Density |
| 沸点 | 167-169 °C |
| EPAの化学物質情報 | Isoheptanol (51774-11-9) |
安全性と法規制
| GHS 分類 | DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P261, P264, P264+P265, P271, P280, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P332+P317, P362+P364, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 99 reports by companies from 2 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.H226 (100%): Flammable liquid and vapor [Warning Flammable liquids] |
|---|---|
| 規制情報 | Chemical: IsoheptanolIsoheptanol: Does not have an individual approval but may be used under an appropriate group standard |
| Hazard Classes and Categories | Flam. Liq. 3 (100%)Skin Irrit. 2 (100%) |
| 危険有害性情報 | コード 危険有害性情報 危険有害性クラス 区分 注意喚起語 シンボル P コード H315 |
用途
一般的な説明
A clear colorless liquid with a pleasant odor. Flash point 106°F. Less dense than water and insoluble in water. Vapors heavier than air. Used to make other chemicals, as a solvent, and in cosmetic formulations.