29171-72-0
29171-72-0结构式
- 常用中文名：4-二丙氨磺酰苄氧基氯
- 常用英文名：4-[(DIPROPYLAMINO)SULFONYL]BENZENE-1-CARBONYL CHLORIDE
- CAS号：29171-72-0
- 分子式：C13H18ClNO3S
- 分子量：303.80500
- 相关类别： 有机原料 氨基化合物 磺酸类氨基化合物
- 发布时间：2018-07-12 21:26:55
- 更新时间：2024-01-14 15:46:30
| 中文名 | 4-二丙氨磺酰苄氧基氯 |
|---|---|
| 英文名 | 4-(dipropylsulfamoyl)benzoyl chloride |
| 中文别名 |
4-二正丙氨磺酰苄氧基氯
4-[(二丙基氨基)磺酸]苯-1-碳酰氯 |
| 英文别名 |
4-(N-dipropylsulfamoyl)benzoyl chloride
p-(Dipropylsulfamoyl)-benzoylchlorid p-(dipropylsulfamoyl)benzoyl chloride 4-(di-n-propylsulfamoyl) benzoyl chloride 4-[(Dipropylamino)Sulfonyl]Benzene-1-Carbonyl Chloride 4--(dipropylsulfamoyl)benzoyl chloride MFCD00121817 |
| 密度 | 1.227g/cm3 |
|---|---|
| 沸点 | 411.3ºC at 760 mmHg |
| 熔点 | 62-63ºC |
| 分子式 | C13H18ClNO3S |
| 分子量 | 303.80500 |
| 闪点 | 202.5ºC |
| 精确质量 | 303.07000 |
| PSA | 62.83000 |
| LogP | 3.95710 |
| 蒸汽压 | 5.66E-07mmHg at 25°C |
| 折射率 | 1.533 |
| 储存条件 | 持贮藏器密封、储存在阴凉、干燥的地方，确保工作间有良好的通风或排气装置 |
| 稳定性 | 如果遵照规格使用和储存则不会分解，未有已知危险反应 避免氧化物 |
| 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:4 4.可旋转化学键数量:7 5.互变异构体数量:无 6.拓扑分子极性表面积62.8 7.重原子数量:19 8.表面电荷:0 9.复杂度:377 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：粉末 2. 密度（g/mL,25℃）：未确定 3. 相对蒸汽密度（g/mL,空气=1）：未确定 4. 熔点（ºC）：59-60 5. 沸点（ºC,常压）：未确定 6. 沸点（ºC, KPa）：未确定 7. 折射率：未确定 8. 闪点（ºC）：未确定 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（Pa,25ºC）：未确定 12. 饱和蒸气压（KPa,25ºC）：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: 34 Section 3 - HAZARDS IDENTIFICATION EMERGENCY OVERVIEW
Causes burns.Moisture sensitive. Potential Health Effects Eye: Causes eye burns. Skin: Causes skin burns. Ingestion: Causes gastrointestinal tract burns. Inhalation: Causes chemical burns to the respiratory tract. Chronic: Not available. Section 4 - FIRST AID MEASURES Eyes: Immediately 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 immediately. Immediately flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes. Ingestion: Do not induce vomiting. Get medical aid immediately. Wash mouth out with water. Inhalation: Get medical aid immediately. Remove from exposure and move to fresh air immediately. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. 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 foam, dry chemical, or carbon dioxide. Section 6 - ACCIDENTAL RELEASE MEASURES General Information: Use proper personal protective equipment as indicated in Section 8. Spills/Leaks: Vacuum or sweep up material and place into a suitable disposal container. Section 7 - HANDLING and STORAGE Handling: Do not breathe dust, vapor, mist, or gas. Do not get in eyes, on skin, or on clothing. Use only in a chemical fume hood. Storage: Keep refrigerated. (Store below 4C/39F.) Store in a tightly closed container. Store in a dry area. Store under nitrogen. Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION Engineering Controls: Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low. Exposure Limits CAS# 29171-72-0: 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: Solid Color: off-white Odor: Not available. pH: Not available. Vapor Pressure: Not available. Viscosity: Not available. Boiling Point: Not available. Freezing/Melting Point: 62 - 63 deg C 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: C13H18ClNO3S Molecular Weight: 304 Section 10 - STABILITY AND REACTIVITY Chemical Stability: Not available. Conditions to Avoid: Incompatible materials, exposure to moist air or water. Incompatibilities with Other Materials: Strong oxidizing agents, alcohols, amines. Hazardous Decomposition Products: Hydrogen chloride, chlorine, nitrogen oxides, carbon monoxide, oxides of sulfur, carbon dioxide, acrid smoke and fumes. Hazardous Polymerization: Has not been reported Section 11 - TOXICOLOGICAL INFORMATION RTECS#: CAS# 29171-72-0 unlisted. LD50/LC50: Not available. Carcinogenicity: 4-[(Dipropylamino)sulfonyl]benzene-1-carbonylchloride - 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 Shipping Name: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S.* Hazard Class: 8 UN Number: 3261 Packing Group: III IMO Shipping Name: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S. Hazard Class: 8 UN Number: 3261 Packing Group: III RID/ADR Shipping Name: CORROSIVE SOLID, ACIDIC, ORGANIC, N.O.S. Hazard Class: 8 UN Number: 3261 Packing group: III Section 15 - REGULATORY INFORMATION European/International Regulations European Labeling in Accordance with EC Directives Hazard Symbols: C Risk Phrases: R 34 Causes burns. Safety Phrases: S 26 In case of contact with eyes, rinse immediately with plenty of water and seek medical advice. S 36/37/39 Wear suitable protective clothing, 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# 29171-72-0: No information available. Canada None of the chemicals in this product are listed on the DSL/NDSL list. CAS# 29171-72-0 is not listed on Canada's Ingredient Disclosure List. US FEDERAL TSCA CAS# 29171-72-0 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: 通常对水是稍微有危害的，若无政府许可，勿将材料排入周围环境。
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| 危害码 (欧洲) | C |
|---|---|
| 危险品运输编码 | UN3261 |
| 包装等级 | III |
| 海关编码 | 2935009090 |
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29171-72-0 |
| 文献：Hinsberger, Stefan; Huesecken, Kristina; Groh, Matthias; Negri, Matthias; Haupenthal, Joerg; Hartmann, Rolf W. Journal of Medicinal Chemistry, 2013 , vol. 56, # 21 p. 8332 - 8338 |
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29171-72-0 |
| 文献：Merck and Co., Inc. Patent: US3931150 A1, 1976 ; |
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29171-72-0 |
| 文献：Hinsberger, Stefan; Huesecken, Kristina; Groh, Matthias; Negri, Matthias; Haupenthal, Joerg; Hartmann, Rolf W. Journal of Medicinal Chemistry, 2013 , vol. 56, # 21 p. 8332 - 8338 |
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29171-72-0 |
| 文献：Hinsberger, Stefan; Huesecken, Kristina; Groh, Matthias; Negri, Matthias; Haupenthal, Joerg; Hartmann, Rolf W. Journal of Medicinal Chemistry, 2013 , vol. 56, # 21 p. 8332 - 8338 |
| 上游产品 4 | |
|---|---|
| 下游产品 0 | |
| 海关编码 | 2935009090 |
|---|---|
| 中文概述 | 2935009090 其他磺（酰）胺. 增值税率:17.0% 退税率:9.0% 监管条件:无 最惠国关税:6.5% 普通关税:35.0% |
| 申报要素 | 品名, 成分含量, 用途 |
| Summary | 2935009090 other sulphonamides VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:35.0% |