識別子と物理属性
| CAS No. | 27195-67-1 |
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| 分子式 | C8H16 |
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| 平均分子量 | 112.21 g/mol |
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| 単同位体質量 | 112.12520051 g/mol |
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| SMILES | CC1(C)CCCCC1 |
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| InChIKey | QEGNUYASOUJEHD-UHFFFAOYSA-N |
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| PubChem CID | 11549 |
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| ChEBI | CHEBI:229279 |
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| EC No. | 209-687-3 |
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| DTXSID | DTXSID1074832 |
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化学・物理的性質
| XLogP | 3.9 |
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| 極性表面積 | 0 |
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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 | 0 |
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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 | 64.1 |
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| Solvents | Solvents -> Aliphatics, Saturated (<C12) |
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| SpringerMaterials Properties | Schoenflies notation |
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| 蒸気圧 | 22.7 [mmHg] |
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| Physical Description | Clear colorless liquid[Sigma-Aldrich MSDS] |
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| 融点 | -33.3 °C |
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| 沸点 | 119.6 °C |
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| 密度 | 0.798 g/cm3(Temp: 15 °C) |
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安全性と法規制
| GHS 分類 | DangerH225 (100%): Highly Flammable liquid and vapor [Danger Flammable liquids]P210, P233, P240, P241, P242, P243, P280, P303+P361+P353, P370+P378, P403+P235, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 42 reports by companies from 1 notifications to the ECHA C&L Inventory. |
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| 火災危険 | · HIGHLY FLAMMABLE: Will be easily ignited by heat, sparks or flames. |
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| 健康有害性 | CAUTION: Petroleum crude oil (UN1267) may contain TOXIC hydrogen sulphide gas. |
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| 有害性の概要 | May cause irritation[Sigma-Aldrich MSDS] See Cyclohexane. |
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| 輸送番号・ガイド（DOT） | 2263 128 |
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| DOT Hazard Classification | DimethylcyclohexanesUN2263Class 3 Flammable and combustible liquid (49 eCFR § 173.120)PG II: the degree of danger presented by the material is medium |
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| Hazard Classes and Categories | Flam. Liq. 2 (100%) |
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| 漏出応急措置 | · CALL 911. Then call emergency response telephone number on shipping paper. If shipping paper not available or no answer, refer to appropriate telephone number listed on the inside back cover.· ELIMINATE all ignition sources (no smoking, flares, sparks or flames) from immediate area. |
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| 応急処置 | General First Aid: |
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| 暴露管理・個人防護 | · Wear positive pressure self-contained breathing apparatus (SCBA). |
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| Isolation and Evacuation | Immediate precautionary measure |
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| Emergency Response Planning Guidelines | CAUTION: The majority of these products have a very low flash point. Use of water spray when fighting fire may be inefficient. |
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| 有害作用 | Neurotoxin - Acute solvent syndrome |
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