化工社化工社 化学情報印刷レポート · 研究参考用
ヘキサクロロ-2-プロペン
ヘキサクロロプロペン · ヘキサクロロ-1-プロペン · ヘキサクロロ-2-プロペン · ヘキサクロロプロペン STANDARD · ヘキサクロロプロピレン STANDARD · ヘキサクロロプロピレン Standard, 1000 µg/mL in MeOH · ヘキサクロロプロペン Standard, 100 µg/mL in MeOH · ヘキサクロロプロパ-1-エン
識別子と物理属性
| CAS No. | 1888-71-7 |
|---|---|
| 分子式 | C3Cl6 |
| 平均分子量 | 248.7 g/mol |
| 単同位体質量 | 245.81311608 g/mol |
| SMILES | ClC(Cl)=C(Cl)C(Cl)(Cl)Cl |
| InChIKey | VFDYKPARTDCDCU-UHFFFAOYSA-N |
| PubChem CID | 15902 |
| EC No. | 217-560-9 |
| DTXSID | DTXSID7062039 |
| 現地名 | ヘキサクロロ-2-プロペン |
化学・物理的性質
| XLogP | 4.2 |
|---|---|
| 極性表面積 | 0 |
| 水素結合供与体数 | 0 |
| 水素結合受容体数 | 0 |
| 回転可能結合数 | 0 |
| 重原子数 | 9 |
| 形式電荷 | 0 |
| 複雑度 | 126 |
| Solvents | Solvents -> Chlorinated Aliphatics |
| SpringerMaterials Properties | Schoenflies notation |
| 密度 | 1.7632 at 20 °C/4 °C1.76 @ 20°C1.765 g/mL at 25 °C(lit.) |
| Color/Form | WATER-WHITE LIQUID |
| 溶解度 | MIscible with alcohol, ether, chlorinated solventsIn water= 17 mg/l at 25 °Cアセトニトリル（微量）、クロロホルム（微量）、メタノール（微量）水に不溶。 |
| 沸点 | 209.5 °C209-210 °C(lit.) |
| 融点 | -72.9 °C-73°C |
| 蒸気圧 | 0.24 [mmHg]0.244 mm Hg at 25 °C /from experimentally-derived coefficients/0.244 [mm Hg] @25 °C |
| 屈折率 | Index of Refraction= 1.5091 at 20 °Cn20/D 1.549(lit.) |
| Physical Description | Hexachloropropene is a clear colorless liquid. Insoluble in water. Used as a plasticizer and hydraulic fluid.Water-white liquid[HSDB] Colorless liquid[MSDSonline] |
| 蒸気密度 | 8.3 (vs air) |
| 引火点 | 209-210°C |
| 貯蔵条件 | Refrigerator, Under inert atmosphere |
| 外観・状態 | 油 |
| 色 | 無色 |
| BRN | 1766640 |
| ヘンリー定数 | 2.1×10-3 mol/(m3Pa) at 25℃, Duchowicz et al. (2020) |
| 誘電率 | 2.7799999999999998 |
| 安定性 | 安定。強力な酸化剤とは相容れない。 |
| CAS データベース | 1888-71-7(CAS DataBase Reference) |
| EPAの化学物質情報 | Hexachloropropene (1888-71-7) |
化学的特性
colourless liquid
安全性と法規制
| GHS 分類 | DangerH315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]P260, P261, P264, P264+P265, P271, P280, P284, P302+P352, P304+P340, P305+P351+P338, P316, P317, P319, P320, 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 47 reports by companies from 4 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies. |
|---|---|
| 規制情報 | Chemical: 1-Propene, 1,1,2,3,3,3-hexachloro-S - indicates a substance that is identified in a final Significant New Use Rule.Hexachloropropene: Does not have an individual approval but may be used under an appropriate group standardThe New Jersey Worker and Community Right to Know Act requires public and private employers to provide information about hazardous substances at their workplaces. (N.J.S.A. 34:5A-1 et. seq.) |
| 輸送ラベル（DOT） | Poison Inhalation Hazard |
| 火災危険 | Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]: |
| 健康有害性 | Excerpt from ERG Guide 151 [Substances - Toxic (Non-Combustible)]: |
| 有害性の概要 | May cause liver damage when ingested[HSDB] A skin and eye irritant[eChemPortal: ERMA] An irritantMay cause lacrimationEffects in high-dose animal studies include liver and kidney injury[MSDSonline] |
| 反応性グループ | Halogenated Organic Compounds |
| RCRA 要件 | U243As stipulated in 40 CFR 261.33, when hexachloropropene, as a commercial chemical product or manufacturing chemical intermediate or an off-specification commercial chemical product or a manufacturing chemical intermediate, becomes a waste, it must be managed according to Federal and/or State hazardous waste regulations. Also defined as a hazardous waste is any residue, contaminated soil, water, or other debris resulting from the cleanup of a spill, into water or on dry land, of this waste. Generators of small quantities of this waste may qualify for partial exclusion from hazardous waste regulations (40 CFR 261.5). |
| TSCA 要件 |
用途
使用
Hexachloropropene is used in method for purifying Hydrofluorocarbons.
一般的な説明
Clear colorless liquid. Insoluble in water. Used as a plasticizer and hydraulic fluid.