3077-13-2

• 常用中文名：N,N-双(2-羟丙基)苯胺
• 常用英文名：N,N-BIS(2-HYDROXYPROPYL)ANILINE
• CAS号：3077-13-2
• 分子式：C₁₂H₁₉NO₂
• 分子量：209.28500
• 发布时间：2018-10-23 10:05:01
• 更新时间：2024-01-02 16:50:38

名称

• 中文名: 1,1’-(苯基亚氨基)双-2-丙醇
• 英文名: n,n-bis(2-hydroxypropyl)aniline
• 中文别名: N,N-双(2-羟丙基)苯胺; N,N-二(2-羟丙基)苯胺; 1,1'-(苯基亚氨基)双-2-丙醇
• 英文别名: N-(2-hydroxypropyl)aniline; N,N-bis(2-hydroxypropyl)-aniline; N,N-Bis(2-hydroxypropyl)aniline N,N-Bis-(2-hydroxy-propyl)-anilin; N-phenyl-bis-(2-hydroxypropyl)amine; 1,1'-phenyliminodipropan-2-ol; 1,1'-(PHENYLIMINO)DI-2-PROPANOL; ANILINODI-2-PROPANOL; EINECS 221-360-7; Anilinodi-2-propanol (DL- and meso- mixture); 1-[N-(2-hydroxypropyl)anilino]propan-2-ol; 1,1'-(phenylazanediyl)dipropan-2-ol; N,N-Bis(2-hydroxypropyl)aniline (DL- and meso- mixture); 2-Propanol,1,1-(phenylimino)bis; 1,1'-(Phenylimino)di-2-propanol (DL- and meso- mixture)

物化性质

• 分子式: C₁₂H₁₉NO₂
• 分子量: 209.28500
• 精确质量: 209.14200
• PSA: 43.70000
• LogP: 1.25460
• 储存条件:

  密闭于阴凉干燥环境中

• 稳定性:

  遵照规定使用和储存则不会分解。

• 分子结构:

  1、 摩尔折射率：62.08

  2、 摩尔体积（m³/mol）：189.2

  3、 等张比容（90.2K）：496.6

  4、 表面张力（dyne/cm）：47.4

  5、 极化率（10^-24cm³）：24.61

• 计算化学:

  1.疏水参数计算参考值（XlogP）:1.5

  2.氢键供体数量:2

  3.氢键受体数量:3

  4.可旋转化学键数量:5

  5.互变异构体数量:无

  6.拓扑分子极性表面积43.7

  7.重原子数量:15

  8.表面电荷:0

  9.复杂度:159

  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:2

  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：无可用

  2. 密度（g/mL,25/4℃）：无可用

  3. 相对蒸汽密度（g/mL,空气=1）：无可用

  4. 熔点（ºC）：无可用

  5. 沸点（ºC,常压）：无可用

  6. 沸点（ºC,5.2kPa）：无可用

  7. 折射率：无可用

  8. 闪点（ºC）：无可用

  9. 比旋光度（º）：无可用

  10. 自燃点或引燃温度（ºC）：无可用

  11. 蒸气压（kPa,25ºC）：无可用

  12. 饱和蒸气压（kPa,60ºC）：无可用

  13. 燃烧热（KJ/mol）：无可用

  14. 临界温度（ºC）：无可用

  15. 临界压力（KPa）：无可用

  16. 油水（辛醇/水）分配系数的对数值：无可用

  17. 爆炸上限（%,V/V）：无可用

  18. 爆炸下限（%,V/V）：无可用

  19. 溶解性：无可用

MSDS

N,N-Bis(2-hydroxypropyl)aniline (DL- and meso- Revision number: 6 mixture) SAFETY DATA SHEET Section1. IDENTIFICATION Product name:N,N-Bis(2-hydroxypropyl)aniline (DL- and meso- mixture) Revision number:6 Section2. HAZARDS IDENTIFICATION GHS classification PHYSICAL HAZARDSNot classified Not classified HEALTH HAZARDS ENVIRONMENTAL HAZARDSNot classified GHS label elements, including precautionary statements Pictograms or hazard symbolsNone Signal wordNo signal word Hazard statementsNone Precautionary statements:None Section3. COMPOSITION/INFORMATION ON INGREDIENTS Substance Substance/mixture: Components:N,N-Bis(2-hydroxypropyl)aniline (DL- and meso- mixture) >85.0%(GC) Percent: CAS Number:3077-13-2 Anilinodi-2-propanol (DL- and meso- mixture) , 1,1'-(Phenylimino)di-2-propanol (DL- Synonyms: and meso- mixture) Chemical Formula:C12H19NO2 Section4. FIRST AID MEASURES Remove victim to fresh air and keep at rest in a position comfortable for breathing. Inhalation: Get medical advice/attention if you feel unwell. Remove/Take off immediately all contaminated clothing. Rinse skin with Skin contact: water/shower. If skin irritation or rash occurs: Get medical advice/attention. Rinse cautiously with water for several minutes. Remove contact lenses, if present Eye contact: and easy to do. Continue rinsing. If eye irritation persists: Get medical advice/attention. Ingestion:Get medical advice/attention if you feel unwell. Rinse mouth. Protection of first-aiders:A rescuer should wear personal protective equipment, such as rubber gloves and air- tight goggles. Section5. FIRE-FIGHTING MEASURES Suitable extinguishingDry chemical, foam, water spray, carbon dioxide. media: Specific hazards arising Take care as it may decompose upon combustion or in high temperatures to generate poisonous fume. from the chemical: N,N-Bis(2-hydroxypropyl)aniline (DL- and meso- mixture) Section5. FIRE-FIGHTING MEASURES Precautions for firefighters: Fire-extinguishing work is done from the windward and the suitable fire-extinguishing method according to the surrounding situation is used. Uninvolved persons should evacuate to a safe place. In case of fire in the surroundings: Remove movable containers if safe to do so. Special protectiveWhen extinguishing fire, be sure to wear personal protective equipment. equipment for firefighters: Section6. ACCIDENTAL RELEASE MEASURES Use personal protective equipment. Keep people away from and upwind of spill/leak. Personal precautions, protective equipment and Ensure adequate ventilation. Entry to non-involved personnel should be controlled emergency procedures: around the leakage area by roping off, etc. Environmental precautions: Prevent product from entering drains. Methods and materials for Absorb spilled material in a suitable absorbent (e.g. rag, dry sand, earth, saw-dust). containment and cleaning In case of large amount of spillage, contain a spill by bunding. Adhered or collected up: material should be promptly disposed of, in accordance with appropriate laws and regulations. Section7. HANDLING AND STORAGE Precautions for safe handling Technical measures:Handling is performed in a well ventilated place. Wear suitable protective equipment. Prevent generation of vapour or mist. Wash hands and face thoroughly after handling. Use a ventilation, local exhaust if vapour or aerosol will be generated. Advice on safe handling: Avoid contact with skin, eyes and clothing. Conditions for safe storage, including any incompatibilities Storage conditions:Keep container tightly closed. Store in a cool and dark place. Store under inert gas. Store away from incompatible materials such as oxidizing agents. Air-sensitive Packaging material:Comply with laws. Section8. EXPOSURE CONTROLS / PERSONAL PROTECTION Install a closed system or local exhaust as possible so that workers should not be Engineering controls: exposed directly. Also install safety shower and eye bath. Personal protective equipment Respiratory protection: Vapor respirator. Follow local and national regulations. Protective gloves. Hand protection: Eye protection:Safety glasses. A face-shield, if the situation requires. Skin and body protection: Protective clothing. Protective boots, if the situation requires. Section9. PHYSICAL AND CHEMICAL PROPERTIES Physical state (20°C):Liquid Form:Clear Colorless - Slightly pale yellow Colour: Odour:No data available pH: No data available Melting point/freezing point:No data available No data available Boiling point/range: Flash point:No data available Flammability or explosive limits: Lower:No data available Upper:No data available Relative density:No data available Solubility(ies): N,N-Bis(2-hydroxypropyl)aniline (DL- and meso- mixture) Section9. PHYSICAL AND CHEMICAL PROPERTIES [Water]No data available [Other solvents]No data available Section10. STABILITY AND REACTIVITY Chemical stability:Stable under proper conditions. Possibility of hazardous No special reactivity has been reported. reactions: Incompatible materials: Oxidizing agents Hazardous decomposition Carbon monoxide, Carbon dioxide, Nitrogen oxides (NOx) products: Section11. TOXICOLOGICAL INFORMATION Acute Toxicity:No data available Skin corrosion/irritation: No data available Serious eyeNo data available damage/irritation: Germ cell mutagenicity: No data available Carcinogenicity: No data available IARC = NTP =No data available Reproductive toxicity:No data available Section12. ECOLOGICAL INFORMATION Ecotoxicity: Fish:No data available No data available Crustacea: Algae:No data available Persistence / degradability: No data available BioaccumulativeNo data available potential(BCF): Mobility in soil Log Pow:No data available Soil adsorption (Koc):No data available Henry's LawNo data available constant(PaM3/mol): Section13. DISPOSAL CONSIDERATIONS Recycle to process, if possible. Consult your local regional authorities. You may be able to burn in a chemical incinerator equipped with an afterburner and scrubber system. Observe all federal, state and local regulations when disposing of the substance. Section14. TRANSPORT INFORMATION Hazards Class:Does not correspond to the classification standard of the United Nations UN-No:Not listed Section15. REGULATORY INFORMATION Safe management ordinance of dangerous chemical product (State Council announces on January 26, 2002 and revised on February 16,2011): Safe use and production, the storage of a dangerous chemical, transport, loading and unloading were prescribed. N,N-Bis(2-hydroxypropyl)aniline (DL- and meso- mixture) SECTION 16 - ADDITIONAL INFORMATION N/A

毒性和生态

生态学数据: 该物质对环境可能有危害，对水体应给予特别注意。

安全

• 海关编码: 2922199090

合成路线

74497-02-2 75-56-9 ~% 3077-13-2

文献：Journal of the American Chemical Society, , vol. 61, p. 2704

74497-02-2 75-56-9 ~0% 3233-06-5 3077-13-2

文献：Journal of Organic Chemistry, , vol. 76, # 21 p. 8768 - 8780

996-21-4 74497-02-2 ~2% 3233-06-5 3077-13-2

文献：Bioorganic and Medicinal Chemistry, , vol. 17, # 7 p. 2925 - 2935

108-32-7 74497-02-2 ~% 109605-09-6 16955-09-2 详细

文献：Organic and Biomolecular Chemistry, , vol. 8, # 22 p. 5187 - 5198

17639-93-9 74497-02-2 ~% 3077-13-2

文献：Journal of Heterocyclic Chemistry, , vol. 28, # 5 p. 1369 - 1372

上下游产品

上游产品  4
75-56-9 996-21-4 108-32-7 17639-93-9
下游产品  0

海关

海关编码	2922199090
中文概述	2922199090. 其他氨基醇及其醚，酯和它们的盐（但含一种以上含氧基的除外）. 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:30.0%
申报要素	品名, 成分含量, 用途, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
Summary	2922199090. other amino-alcohols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%