415918-91-1

• 常用中文名：(11bR)-N,N-双[(R)-1-苯基乙基]-联萘并[2,1-d:1',2'-f][1,3,2]二氧膦杂-4-胺
• 常用英文名：(R)-2,2-Binaphthoyl-(S,S)-di(1-phenylethyl)aminoylphosphine
• CAS号：415918-91-1
• 分子式：C₃₇H₃₂Cl₂NO₂P
• 分子量：624.53500
• 发布时间：2018-11-28 15:48:50
• 更新时间：2024-01-04 19:26:51

名称

• 中文名: (S,R,R)-(+)-(3,5-二氧杂-4-磷杂环庚二烯并[2,1-a:3,4-a’]二萘-4-基)二[1-苯基乙基]胺
• 英文名: (s)-(+)-(3,5-dioxa-4-phospha-cyclohepta[2,1-a:3,4-a']dinaphthalen-4-yl)bis[(1r)-1-phenylethyl]amine,dichloromethane adduct
• 中文别名: (S,R,R)-(+)-(3,5-二氧杂-4-磷杂环庚二烯并[2,1-A; 3,4-A']二萘-4-基)双[(1R)-1-苯基乙基]胺,二氯甲基加合物; (S)-(+)-(3,5-二氧杂-4-磷杂-环庚[2,1-A; 3,4-A']二萘-4-基)二[1-苯基乙基]胺; (S,R,R)-(+)-(3,5-二氧杂-4-磷杂环庚二烯并[2,1-a; (S,R,R)-(+)-(3,5-二氧杂-4-磷杂环庚二烯并[2,1-A,3,4-A']二萘-4-基)二[1-苯基乙基]胺
• 英文别名: 3,4-a']dinaphthalen-4-yl)bis[(1R)-1-phenylethyl]aMine; (S,R,R)-(+)-(3,5-Dioxa-4-phosphacyclohepta[2,1-a; (S,R,R)-(+)-(3,5-DIOXA-4-PHOSPHA-CYCLOHE; MFCD08561138; (+)-N,N-Bis[(1R)-1-phenylethyl]-dinaphtho[2,1-d:1

物化性质

• 沸点: 710.7ºC at 760 mmHg
• 熔点: 102-103ºC
• 分子式: C₃₇H₃₂Cl₂NO₂P
• 分子量: 624.53500
• 闪点: 383.6ºC
• 精确质量: 623.15500
• PSA: 29.52000
• LogP: 12.47830
• 外观性状: 固体;White to Light yellow powder to crystal
• 储存条件:

  密封于阴凉干燥环境中

• 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：无可用

  2、 摩尔体积（cm³/mol）：无可用

  3、 等张比容（90.2K）：无可用

  4、 表面张力（dyne/cm）：无可用

  5、 极化率：无可用

• 计算化学:

  1、 疏水参数计算参考值（XlogP）：9.9

  2、 氢键供体数量：0

  3、 氢键受体数量：3

  4、 可旋转化学键数量：5

  5、 拓扑分子极性表面积（TPSA）：29.5

  6、 重原子数量：40

  7、 表面电荷：0

  8、 复杂度：747

  9、 同位素原子数量：0

  10、 确定原子立构中心数量：2

  11、 不确定原子立构中心数量：0

  12、 确定化学键立构中心数量：0

  13、 不确定化学键立构中心数量：0

  14、 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）：102-103

  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

Section 1: Product Identification (S)-(+)-(3,5-Dioxa-4-phospha-cyclohepta[2,1-a;3,4-a']dinaphthalen-4-yl)bis[(1R)-1-phenylethyl]amine, Chemical Name: dichloromethane adduct, min. 95% CAS Registry Number:415918-91-1 Formula:C36H30NO2P EINECS Number:none Chemical Family:Phosphoramidite Synonym:none Section 2: Composition and Information on Ingredients IngredientCAS NumberPercentACGIH (TWA)OSHA (PEL) Title Compound415918-91-1100%no datano data Section 3: Hazards Identification Emergency Overview:Irritating to the respiratory tract, skin and eyes. May be harmful if swallowed. Primary Routes of Exposure:Ingestion, eyes, inhalation Eye Contact:Causes moderate irritation of the eyes. Skin Contact:Causes slight to mild irritation of the skin. Inhalation:Irritating to the nose, mucous membranes and respiratory tract. Ingestion:May be harmful if swallowed. No specific information is available on the physiological effects of ingestion. Acute Health Affects:Irritating to skin, eyes and respiratory tract. Chronic Health Affects:No information available on long-term chronic effects. NTP:No IARC:No OSHA:No SECTION 4: First Aid Measures Immediately flush the eyes with copious amounts of water for at least 10-15 minutes. A victim may need Eye Exposure: assistance in keeping their eye lids open. Get immediate medical attention. Wash the affected area with water. Remove contaminated clothes if necessary. Seek medical assistance if Skin Exposure: irritation persists. Remove the victim to fresh air. Closely monitor the victim for signs of respiratory problems, such as difficulty Inhalation: in breathing, coughing, wheezing, or pain. In such cases seek immediate medical assistance. Seek medical attention immediately. Keep the victim calm. Give the victim water (only if conscious). Induce Ingestion: vomiting only if directed by medical personnel. SECTION 5: Fire Fighting Measures Flash Point:none Autoignition Temperature:none Explosion Limits:none Extinguishing Medium:carbon dioxide, dry powder or foam Fire fighters should be equipped with a NIOSH approved positive pressure self-contained breathing apparatus Special Fire Fighting Procedures: and full protective clothing. Hazardous Combustion andIf involved in a fire this material may emit toxic organic fumes and vapors of phosphorus pentoxide. Decomposion Products: Unusual Fire or Explosion Hazards: No unusual fire or explosion hazards. SECTION 6: Accidental Release Measures Small spills can be mixed with vermiculite, sodium carbonate or other suitable non combustible adsorbent and Spill and Leak Procedures: swept up. SECTION 7: Handling and Storage Keep material in a tightly sealed container. Prolonged exposure to moisture will result in degradation of the Handling and Storage: product. Handle and store material under a dry atmosphere. SECTION 8: Exposure Controls and Personal Protection Eye Protection:Always wear approved safety glasses when handling a chemical substance in the laboratory. Skin Protection:Wear protective clothing and gloves. Consult with glove manufacturer to determine the proper type of glove. Ventilation:Material may form a fine dust. If possible, handle the material in an efficient fume hood. If ventilation is not available a respirator should be worn. The use of respirators requires a Respirator Respirator: Protection Program to be in compliance with 29 CFR 1910.134. Ventilation:Material may form a fine dust. If possible, handle the material in an efficient fume hood. Additional Protection:No additional protection required. SECTION 9: Physical and Chemical Properties Color and Form:white pwdr. Molecular Weight:539.6 Melting Point:102-103° Boiling Point:no data Vapor Pressure:not applicable Specific Gravity:no data Odor:none Solubility in Water:reacts slowly with water SECTION 10: Stability and Reactivity Stability:air stable, moisture sensitive Hazardous Polymerization:no hazardous polymerization Conditions to Avoid:extended exposure to moisture and acids Incompatibility:oxidizing agents Decomposition Products:carbon monoxide, phosphorus pentoxide, nitrogen and nitrogen oxides, and organic fumes. SECTION 11: Toxicological Information RTECS Data:No information available in the RTECS files. Carcinogenic Effects:no data Mutagenic Effects:no data Tetratogenic Effects:no data SECTION 12: Ecological Information Ecological Information:No information available SECTION 13: Disposal Considerations Disposal:Dispose of according to federal, state, and local regulations. SECTION 14: Transportation Shipping Name (CFR):Non-hazardous Hazard Class (CFR):NA Additional Hazard Class (CFR):NA Packaging Group (CFR):NA UN ID Number (CFR):NA Shipping Name (IATA):Non-hazardous Hazard Class (IATA):NA Additional Hazard Class (IATA):NA Packaging Group (IATA):NA UN ID Number (IATA):NA SECTION 15: Regulatory Information TSCA:Not listed in the TSCA inventory. SARA (Title 313):Title compound not listed. Second Ingredient:none 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。