[1,3-双[2,6-二异丙基苯基]-2-咪唑烷亚基]二氯[[2-(异丙氧基)-5-[(2,2,2-三氟乙酰基)氨基]苯基]亚甲基]-钌

[1,3-双[2,6-二异丙基苯基]-2-咪唑烷亚基]二氯[[2-(异丙氧基)-5-[(2,2,2-三氟乙酰基)氨基]苯基]亚甲基]-钌 基本信息
CAS号 1212008-99-5 分子式 C39H50Cl2F3N3O2Ru
分子量 821.80400 精确质量  821.22800
PSA  79.52000 LogP  8.13730

基本信息 展开↓

CAS号:
1212008-99-5
分子式:
C39H50Cl2F3N3O2Ru
分子量:
821.80400
中文名称:
[1,3-双[2,6-二异丙基苯基]-2-咪唑烷亚基]二氯[[2-(异丙氧基)-5-[(2,2,2-三氟乙酰基)氨基]苯基]亚甲基]-钌
英文名称:
[1,3-Bis(2,6-diisopropylphenyl)-2-imidazolidinylidene](dichloro){ 2-isopropoxy-5-[(trifluoroacetyl)amino]benzylidene}ruthenium
中文别名:
[1,3-双[2,6-二异丙基苯基]-2-咪唑烷亚基]二氯[[2-(异丙氧基)-5-[(2,2,2-三氟乙酰基)氨基]苯基]亚甲基]-钌;
[1,3-二(2,6-二-异丙基苯基)-4,5-二氢咪唑-2-亚基]-[2-异丙氧基-5-(三氟乙酰氨基)苯基]亚甲基钌(II),二氯
英文别名:
[1,3-Bis(2,6-diisopropylphenyl)-2-imidazolidinylidene](dichloro){ 2-isopropoxy-5-[(trifluoroacetyl)amino]benzylidene}ruthenium;
[1,3-Bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro-[(2-isopropoxy)(5-trifluoroacetamido)benzylidene]ruthenium(II);
[1,3-Bis[2,6-bis(1-methylethyl)phenyl]-2-imidazolidinylidene]dichloro[[2-(1-methylethoxy)-5-[(2,2,2-trifluoroacetyl)amino]phenyl]methylene]-ruthenium
精确分子量/精确质量:
821.22800
极性分子表面积/PSA:
79.52000
油水分配系数/LogP:

LogP值指的是某物质在正辛醇/水两相体系中的分配系数的对数值,反映了物质在油水两相中的分配情况。其中、LogP值越大,说明该物质越亲油;反之,LogP值越小,则说明该物质越亲水。
InChI:
InChI=1S/C27H38N2.C12H12F3NO2.2ClH.Ru/c1-18(2)22-11-9-12-23(19(3)4)26(22)28-15-16-29(17-28)27-24(20(5)6)13-10-14-25(27)21(7)8;1-7(2)18-10-5-4-9(6-8(10)3)16-11(17)12(13,14)15;;;/h9-14,18-21H,15-16H2,1-8H3;3-7H,1-2H3,(H,16,17);2*1H;/q;;;;+2/p-2

MSDS 展开↓


Section 1: Product Identification
   [1,3-Bis(2,6-di-i-propylphenyl)-4,5-dihydroimidazol-2-ylidene]-[2-i-propoxy-5-(trifluoroacetamido)phenyl]methyl
   Chemical Name:
   eneruthenium(II) dichloride M71-S1Pr
   CAS Registry Number:       1212008-99-5    
   Formula:       C39H50Cl2F3N3O2Ru    
   EINECS Number:       none    
   Chemical Family:       organometallic complex    
   Synonym:       none    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title compound       1212008-99-5       100%       no data       no data    

Section 3: Hazards Identification
   Emergency Overview:       Irritating to skin, eyes and respiratory tract.    
   Primary Routes of Exposure:       Ingestion, inhalation    
   Eye Contact:       Causes slight to mild 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:       No information available on the physiological effects of ingestion. May be harmful if swallowed.    
   Acute Health Affects:       Irritating to skin, eyes and respiratory tract.    
   Chronic Health Affects:       No information 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 product 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 irritating fumes.    
   Decomposion Products:
   Unusual Fire or Explosion Hazards: No unususal 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
   Handling and Storage:       Store in a tightly sealed container. Keep in a cool, dry, well ventilated place.    

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:       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:       Handle the material in an efficient fume hood.    
   Additional Protection:       No additional protection required.    

SECTION 9: Physical and Chemical Properties
   Color and Form:       green powder    
   Molecular Weight:       821.80    
   Melting Point:       no data    
   Boiling Point:       no data    
   Vapor Pressure:       no data    
   Specific Gravity:       no data    
   Odor:       none    
   Solubility in Water:       insoluble    

SECTION 10: Stability and Reactivity
   Stability:       air and moisture stable    
   Hazardous Polymerization:       no hazardous polymerization    
   Conditions to Avoid:       none    
   Incompatibility:       oxidizing agents and halogens    
   Decomposition Products:       carbon monoxide, carbon dioxide, ruthenium oxide, fluorinated by-products 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 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 in the TSCA inventory    
   SARA (Title 313):       Title compound not listed    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A
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