| 中文名 | 3-(苯基硫代)噻吩 |
|---|---|
| 英文名 | 3-phenylsulfanylthiophene |
| 中文别名 | 3-(苯硫基)噻吩 |
| 英文别名 |
MFCD00052043
3-(PHENYLTHIO)THIOPHENE 3-Thienylphenylsulfid 3-phenylsulfanyl-thiophene Thiophene, 3-(phenylthio)- 3-(Phenylsulfanyl)thiophene |
| 密度 | 1.2±0.1 g/cm3 |
|---|---|
| 沸点 | 304.7±15.0 °C at 760 mmHg |
| 分子式 | C10H8S2 |
| 分子量 | 192.301 |
| 闪点 | 138.1±20.4 °C |
| 精确质量 | 192.006744 |
| PSA | 53.54000 |
| LogP | 4.13 |
| 蒸汽压 | 0.0±0.6 mmHg at 25°C |
| 折射率 | 1.668 |
| 储存条件 | 常温密闭避光，通风干燥 |
| 稳定性 | 常温常压下稳定 避免的物料：氧化物 |
| 分子结构 | 1、 摩尔折射率：57.61 2、 摩尔体积（m3/mol）：154.6 3、 等张比容（90.2K）：414.7 4、 表面张力（dyne/cm）：51.7 5、 极化率（10-24cm3）：22.84 |
| 计算化学 | 1、疏水参数计算参考值（XlogP）:3.7 2、氢键供体数量：0 3、氢键受体数量：0 4、可旋转化学键数量:2 5、互变异构体数量： 6、拓扑分子极性表面积（TPSA）:0 7、重原子数量：12 8、表面电荷：0 9、复杂度：130 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 | 1.性状：未确定 2.密度（g/mL,25/4℃）：未确定 3.相对蒸汽密度（g/mL,空气=1）：未确定 4.熔点（ºC）：未确定 5. 沸点（ºC,常压）： 110 °C 6. 沸点（ºC,5.2kPa）： 未确定7.折射率：未确定 8. 闪点（ºC）： 111-112 9. 比旋光度（º）： 未确定10.自燃点或引燃温度（ºC）：未确定 11.蒸气压（kPa,25ºC）：未确定 12.饱和蒸气压（kPa,60ºC）：未确定 13.燃烧热（KJ/mol）：未确定 14.临界温度（ºC）：未确定 15.临界压力（KPa）：未确定 16.油水（辛醇/水）分配系数的对数值：未确定 17.爆炸上限（%,V/V）：未确定 18.爆炸下限（%,V/V）：未确定 19.溶解性：未确定 |
Synonym: Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
Risk Phrases: None Listed. Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW
Not available. Potential Health Effects Eye: May cause eye irritation. Skin: May cause skin irritation. May be harmful if absorbed through the skin. Ingestion: May cause irritation of the digestive tract. May be harmful if swallowed. Inhalation: May cause respiratory tract irritation. May be harmful if inhaled. Chronic: Not available. 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. Skin: Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Ingestion: Get medical aid. Wash mouth out with water. Inhalation: Remove from exposure and move to fresh air immediately. Notes to Physician: Treat symptomatically and supportively. 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. Extinguishing Media: Use water spray, dry chemical, carbon dioxide, or chemical foam. Section 6 - ACCIDENTAL RELEASE MEASURES General Information: Use proper personal protective equipment as indicated in Section 8. Spills/Leaks: Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable container. Section 7 - HANDLING and STORAGE Handling: Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes. Storage: Store in a cool, dry place. Store in a tightly closed container. Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION Engineering Controls: Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 16718-11-9: Personal Protective Equipment Eyes: Not available. 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: colorless - pale yellow Odor: Not available. pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: 110 - 112 deg C @0.6mmHg Freezing/Melting Point: Not available. Autoignition Temperature: Not available. Flash Point: Not available. Explosion Limits, lower: Not available. Explosion Limits, upper: Not available. Decomposition Temperature: Solubility in water: Specific Gravity/Density: Molecular Formula: C10H8S2 Molecular Weight: 192 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Not available. Conditions to Avoid: Incompatible materials. Incompatibilities with Other Materials: Oxidizing agents. Hazardous Decomposition Products: Carbon monoxide, oxides of sulfur, carbon dioxide. Hazardous Polymerization: Has not been reported Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 16718-11-9 unlisted. LD50/LC50: Not available. Carcinogenicity: 3-(Phenylthio)thiophene - Not listed by ACGIH, IARC, or NTP. 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 No information available. IMO No information available. RID/ADR No information available. Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: Not available. Risk Phrases: Safety Phrases: S 24/25 Avoid contact with skin and eyes. WGK (Water Danger/Protection) CAS# 16718-11-9: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 16718-11-9 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 16718-11-9 is not listed on the TSCA inventory. It is for research and development use only. SECTION 16 - ADDITIONAL INFORMATION N/A |
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生态学数据: 通常对水体是稍微有害的，不要将未稀释或大量产品接触地下水，水道或污水系统，未经政府许可勿将材料排入周围环境。
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| 安全声明 (欧洲) | S24/25 |
|---|---|
| 海关编码 | 2934999090 |
|
~70%
16718-11-9 |
| 文献：Gogoi, Prasanta; Kalita, Mukul; Barman, Pranjit Synlett, 2014 , vol. 25, # 6 art. no. 47, p. 866 - 870 |
|
~98%
16718-11-9 |
| 文献：Eichman, Chad C.; Stambuli, James P. Journal of Organic Chemistry, 2009 , vol. 74, # 10 p. 4005 - 4008 |
|
~69%
16718-11-9 |
| 文献：Xu, Hua-Jian; Zhao, Yong-Qiang; Feng, Teng; Feng, Yi-Si Journal of Organic Chemistry, 2012 , vol. 77, # 6 p. 2878 - 2884 |
|
~69%
16718-11-9 |
| 文献：Uyeda, Christopher; Tan, Yichen; Fu, Gregory C.; Peters, Jonas C. Journal of the American Chemical Society, 2013 , vol. 135, # 25 p. 9548 - 9552 |
| 上游产品 5 | |
|---|---|
| 下游产品 0 | |
| 海关编码 | 2934999090 |
|---|---|
| 中文概述 | 2934999090. 其他杂环化合物. 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 |
| Summary | 2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0% |
