Dichloro[(S)-(-)-2,2-bis(diphenylphosphino)-1,1-binaphthyl][(2S)-(+)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine]ruthenium(II) dichloromethane adduct

  • 基本信息
  • 物化性质
  • 安全信息
  • 毒理性
  • MSDS
  • 结构与计算化学

Dichloro[(S)-(-)-2,2-bis(diphenylphosphino)-1,1-binaphthyl][(2S)-(+)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine]ruthenium(II) dichloromethane adduct 基本信息

中文名称:
Dichloro[(S)-(-)-2,2-bis(diphenylphosphino)-1,1-binaphthyl][(2S)-(+)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine]ruthenium(II) dichloromethane adduct 
中文别名:
二氯[(S)-(-)-2,2'-二(二苯基膦基)-1,1'-联萘基][(2S)-(+)-1,1-二(4-甲氧苯基)-3-甲基-1,2-丁二胺]钌(II)二氯甲烷加合物;
(2S)-1,1-bis(4-methoxyphenyl)-3-methyl-butane-1,2-diamine, dichlo roruthenium, [1-(2-diphenylphosphanyl-1-naphthyl)-2-naphthyl]-dip henyl-phosphane 
英文名称:
Ruthenium,[(1S)-[1,1'-binaphthalene]-2,2'-diylbis[diphenylphosphine-kP]][(2S)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine-kN,kN']dichloro-, (OC-6-14)- (9CI)
英文别名:
(2S)-1,1-bis(4-methoxyphenyl)-3-methyl-butane-1,2-diamine, dichlo roruthenium, [1-(2-diphenylphosphanyl-1-naphthyl)-2-naphthyl]-dip henyl-phosphane;
RuCI2[(R)-BINAP][(R)-DAIPEN];
Dichloro[(R)-(+)-2,2 inverted exclamation marka-bis(diphenylphosphino)-1,1 inverted exclamation marka-binaphthyl][(2R)-(-)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine]ruthenium(II);
RuCI2[(S)-BINAP][(S)-DAIPEN] 
CAS No.:
212143-24-3
分 子 式:
C63H58Cl2N2O2P2Ru
分 子 量:
1109.07
精确分子量:
1108.24000
PSA:
97.68000
InChI:
The Key: ZVVRWLPQKLDJRW-OGLOXHGMSA-L
安全术语:
S22S24/25
分子结构式:
SDS:
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Dichloro[(S)-(-)-2,2-bis(diphenylphosphino)-1,1-binaphthyl][(2S)-(+)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine]ruthenium(II) dichloromethane adduct 物化性质

存储条件/存储方法:

 

密闭于0-6 ºC阴凉干燥环境中

稳定性相关:

 

遵照规定使用和储存则不会分解。

其它信息:

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

Dichloro[(S)-(-)-2,2-bis(diphenylphosphino)-1,1-binaphthyl][(2S)-(+)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine]ruthenium(II) dichloromethane adduct 安全信息

安全说明:
S22-S24/25

Dichloro[(S)-(-)-2,2-bis(diphenylphosphino)-1,1-binaphthyl][(2S)-(+)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine]ruthenium(II) dichloromethane adduct 毒理性

生态数据:

 

该物质对环境可能有危害,对水体应给予特别注意。

Dichloro[(S)-(-)-2,2-bis(diphenylphosphino)-1,1-binaphthyl][(2S)-(+)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine]ruthenium(II) dichloromethane adduct MSDS


Section 1: Product Identification
   Dichloro[(S)-(-)-2,2'-bis(diphenylphosphino)-1,1'-binaphthyl][(2S)-(+)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-b
   Chemical Name:
   utanediamine]ruthenium (II) dichloromethane adduct, min
   CAS Registry Number:       212143-24-3    
   Formula:       C63H58Cl2N2O2P2Ru    
   EINECS Number:       none    
   Chemical Family:       organometallic complex    
   Synonym:       Ruthenium [(S)-BINAP] [(S)-DAIPEN]    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title compound       212143-24-3       100%       no data       no data    

Section 3: Hazards Identification
   Emergency Overview:       No particular hazard associated with this material.    
   Primary Routes of Exposure:       Ingestion    
   Eye Contact:       May cause irritation to the eyes    
   Skin Contact:       May cause slight to mild irritation of the skin.    
   Inhalation:       Inhalation is an unlikely source of exposure.    
   Ingestion:       No information is available on the physiological effects of ingestion.    
   Other than a possible irritant, no information is available on the acute health effects of exposure to this
   Acute Health Affects:
   material.
   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    
   If this material is involved in a fire, fire fighters should be equipped with a NIOSH approved positive pressure
   Special Fire Fighting Procedures:
   self-contained breathing apparatus and full protective clothing.
   Hazardous Combustion and       If involved in a fire this material may emit toxic organic fumes.    
   Decomposion Products:
   Unusual Fire or Explosion Hazards: No unusual fire or explosion hazards.

SECTION 6: Accidental Release Measures
   Spill and Leak Procedures:       Small spills can be mixed with vermiculite or sodium carbonate and swept up.    

SECTION 7: Handling and Storage
   The material will degrade on prolonged exposure to air. Store under an inert atmosphere of nitrogen or argon.
   Handling and Storage:       Keep bottle tightly sealed and away from heat and direct sunlight. For prolonged storage keep material    
   refrigerated.

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.    
   Ventilation:       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 Respiratory
   Respirator:
   Protection Program to be in compliance with 29 CFR 1910.134.
   Ventilation:       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 to pale yellow powder    
   Molecular Weight:       1109.10    
   Melting Point:       >100° (dec)    
   Boiling Point:       decomposes    
   Vapor Pressure:       not applicable    
   Specific Gravity:       no data    
   Odor:       none    
   Solubility in Water:       insoluble    

SECTION 10: Stability and Reactivity
   Stability:       air-sensitive solid (store cold)    
   Hazardous Polymerization:       none    
   Conditions to Avoid:       none    
   Incompatibility:       strong oxidizing agents    
   carbon dioxide, carbon monoxide, hydrogen chloride, phosphorus pentoxide, nitrogen oxides, organic fumes,
   Decomposition Products:
   and ruthenium salts

SECTION 11: Toxicological Information
   RTECS Data:       No data available in the RTECS files    
   Carcinogenic Effects:       No data available    
   Mutagenic Effects:       No data available    
   Tetratogenic Effects:       No data available    

SECTION 12: Ecological Information
   Ecological Information:       No information available    

SECTION 13: Disposal Considerations
   Disposal:       Dispose of according to local, state and federal 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 on the TSCA inventory    
   SARA (Title 313):       not regulated by Title 313    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A

Dichloro[(S)-(-)-2,2-bis(diphenylphosphino)-1,1-binaphthyl][(2S)-(+)-1,1-bis(4-methoxyphenyl)-3-methyl-1,2-butanediamine]ruthenium(II) dichloromethane adduct 分子结构与计算化学数据

分子结构数据

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

计算化学数据

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:3

3.氢键受体数量:3

4.可旋转化学键数量:7

5.互变异构体数量:2

6.拓扑分子极性表面积50.4

7.重原子数量:24

8.表面电荷:0

9.复杂度:353

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:2

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