611-33-6

• 常用中文名：8-氯喹啉
• 常用英文名：8-Chloroquinoline
• CAS号：611-33-6
• 分子式：C₉H₆ClN
• 分子量：163.604
• 相关类别： 医药中间体 杂环化合物 喹啉类化合物
• 发布时间：2018-04-24 08:00:00
• 更新时间：2025-08-26 09:34:08
• 下载msds

名称

• 中文名: 8-氯喹啉
• 英文名: 8-chloroquinoline
• 中文别名: 8-氯代喹啉; 8-氯喹林
• 英文别名: Quinoline,8-chloro; 8-Chloroquinoline; MFCD00047618; EINECS 210-265-6; 8-chloro-quinoline; Quinoline, 8-chloro-; 8-Chlor-chinolin

物化性质

• 密度: 1.3±0.1 g/cm3
• 沸点: 288.5±0.0 °C at 760 mmHg
• 熔点: -20 °C
• 分子式: C₉H₆ClN
• 分子量: 163.604
• 闪点: 145.2±5.4 °C
• 精确质量: 163.018875
• PSA: 12.89000
• LogP: 2.33
• 外观性状: 透明淡黄色液体
• 蒸汽压: 0.0±0.5 mmHg at 25°C
• 折射率: 1.652
• 储存条件:

  贮存：

  将密器密封，储存密封的主藏器内，并放在阴凉， 干爽的位置。

• 稳定性:

  性质与稳定性：

  常温常压下，或不分解产物。

• 水溶解性: SOLUBLE
• 分子结构:

  五、分子性质数据：

  1、 摩尔折射率：47.08

  2、 摩尔体积（m³/mol）：128.7

  3、 等张比容（90.2K）：341.1

  4、 表面张力（dyne/cm）：49.3

  5、 极化率（10 ^-24cm ³）：18.66

• 计算化学:

  1.疏水参数计算参考值（XlogP）:无

  2.氢键供体数量:0

  3.氢键受体数量:1

  4.可旋转化学键数量:0

  5.互变异构体数量:无

  6.拓扑分子极性表面积12.9

  7.重原子数量:11

  8.表面电荷:0

  9.复杂度:138

  10.同位素原子数量:0

  11.确定原子立构中心数量:0

  12.不确定原子立构中心数量:0

  13.确定化学键立构中心数量:0

  14.不确定化学键立构中心数量:0

  15.共价键单元数量:1

• 更多: 物性数据： 1.熔点 -20 °C; 2.沸点 288.5 °C; 3.密度 1.28

MSDS

Name: 8-Chloroquinoline 99% (gc) Material Safety Data Sheet Synonym: CAS: 611-33-6 Section 1 - Chemical Product MSDS Name:8-Chloroquinoline 99% (gc) Material Safety Data Sheet Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS CAS# Chemical Name content EINECS# 611-33-6 8-Chloroquinoline 99.0 210-265-6 Hazard Symbols: XI Risk Phrases: 36/37/38 Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW Irritating to eyes, respiratory system and skin.The toxicological properties of this material have not been fully investigated. Potential Health Effects Eye: Dust may cause mechanical irritation. Skin: No information regarding skin irritation and other potential effects was found. Ingestion: The toxicological properties of this substance have not been fully investigated. May cause central nervous system effects. Inhalation: Inhalation of dust may cause respiratory tract irritation. Chronic: No information found. Section 4 - FIRST AID MEASURES Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid immediately. Skin: Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Wash clothing before reuse. Ingestion: If victim is conscious and alert, give 2-4 cupfuls of milk or water. Never give anything by mouth to an unconscious person. Get medical aid immediately. Inhalation: Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid. Notes to Physician: Section 5 - FIRE FIGHTING MEASURES General Information: As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion. Extinguishing Media: Use agent most appropriate to extinguish fire. Section 6 - ACCIDENTAL RELEASE MEASURES General Information: Use proper personal protective equipment as indicated in Section 8. Spills/Leaks: Clean up spills immediately, observing precautions in the Protective Equipment section. Sweep up or absorb material, then place into a suitable clean, dry, closed container for disposal. Provide ventilation. Section 7 - HANDLING and STORAGE Handling: Wash thoroughly after handling. Remove contaminated clothing and wash before reuse. Use with adequate ventilation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation. Storage: Keep container closed when not in use. Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances. Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION Engineering Controls: Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 611-33-6: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166. Skin: Wear appropriate protective gloves to prevent skin exposure. Clothing: Wear appropriate protective clothing to prevent skin exposure. Respirators: Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced. Section 9 - PHYSICAL AND CHEMICAL PROPERTIES Physical State: Liquid Color: clear slight yellow Odor: Not available. pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: 288.5 deg C @ 760.00MM HG Freezing/Melting Point: -20 deg C Autoignition Temperature: Not available. Flash Point: > 110 deg C (> 230.00 deg F) Explosion Limits, lower: Not available. Explosion Limits, upper: Not available. Decomposition Temperature: Solubility in water: soluble Specific Gravity/Density: Molecular Formula: C9H6ClN Molecular Weight: 163.61 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Stable under normal temperatures and pressures. Conditions to Avoid: Incompatible materials, strong oxidants. Incompatibilities with Other Materials: Oxidizing agents. Hazardous Decomposition Products: Carbon monoxide, oxides of nitrogen, carbon dioxide. Hazardous Polymerization: Has not been reported Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 611-33-6: VB2330000 LD50/LC50: Not available. Carcinogenicity: 8-Chloroquinoline - Not listed by ACGIH, IARC, or NTP. Other: See actual entry in RTECS for complete information. Section 12 - ECOLOGICAL INFORMATION Section 13 - DISPOSAL CONSIDERATIONS Dispose of in a manner consistent with federal, state, and local regulations. Section 14 - TRANSPORT INFORMATION IATA Not regulated as a hazardous material. IMO Not regulated as a hazardous material. RID/ADR Not regulated as a hazardous material. Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: XI Risk Phrases: R 36/37/38 Irritating to eyes, respiratory system and skin. Safety Phrases: S 26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 28A After contact with skin, wash immediately with plenty of water. S 37 Wear suitable gloves. S 37/39 Wear suitable gloves and eye/face protection. S 45 In case of accident or if you feel unwell, seek medical advice immediately (show the label where possible). WGK (Water Danger/Protection) CAS# 611-33-6: No information available. Canada CAS# 611-33-6 is listed on Canada's NDSL List. CAS# 611-33-6 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 611-33-6 is listed on the TSCA inventory. SECTION 16 - ADDITIONAL INFORMATION N/A

毒性和生态

生态学数据: 三、生态学数据： 1、其它有害作用：该物质对环境可能有危害，对水体应给予特别注意。

安全

• 危害码 (欧洲): Xi:Irritant;
• 风险声明 (欧洲): R36/37/38
• 安全声明 (欧洲): S37/39-S26-S36/37/39
• 海关编码: 2933499090

合成路线

95-51-2 56-81-5 ~94% 611-33-6

文献：Wang, Chao; Flanigan, Darrin M.; Zakharov, Lev N.; Blakemore, Paul R. Organic Letters, 2011 , vol. 13, # 15 p. 4024 - 4027

137-04-2 56-81-5 ~78% 611-33-6

文献：Rodriguez, J. Gonzalo; De Los Rios, Cristobal; Lafuente, Antonio Tetrahedron, 2005 , vol. 61, # 38 p. 9042 - 9051

95-51-2 504-63-2 ~48% 611-33-6

文献：Tsuji, Yasushi; Huh, Keun-Tae; Watanabe, Yoshihisa Journal of Organic Chemistry, 1987 , vol. 52, # 9 p. 1673 - 1680

90562-36-0 ~40% 611-33-6

文献：De Kimpe, Norbert; Keppens, Marian Tetrahedron, 1996 , vol. 52, # 10 p. 3705 - 3718

1074-06-2 ~% 611-33-6

文献：Tetrahedron, , vol. 52, # 10 p. 3705 - 3718

176097-81-7 ~% 611-33-6

文献：Tetrahedron, , vol. 52, # 10 p. 3705 - 3718

上下游产品

上游产品  7
95-51-2 56-81-5 137-04-2 504-63-2
90562-36-0 1074-06-2 176097-81-7
下游产品  10
35509-27-4 4470-83-1 938-33-0 22539-55-5
57797-97-4 578-66-5 607742-69-8 129305-09-5
148-24-3 166100-95-4

海关

海关编码	2933499090
中文概述	2933499090. 其他含喹琳或异喹啉环系的化合物〔但未进一步稠合的〕. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素	品名, 成分含量, 用途, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期
Summary	2933499090. other compounds containing in the structure a quinoline or isoquinoline ring-system (whether or not hydrogenated), not further fused. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%