121954-50-5 (1,2-双(二叔丁基膦基甲基)苯,1,2-Bis((di-tert-butylphosphino)methyl)benzene)

CAS号:
121954-50-5
中文名称:
1,2-双(二叔丁基膦基甲基)苯
英文名称:
1,2-Bis((di-tert-butylphosphino)methyl)benzene
分子式:
C24H44P2
分子量:
394.553689002991
相关分类:

1,2-双(二叔丁基膦基甲基)苯(121954-50-5)名称与标识符

名称

中文别名:
α,α'-Bis(二叔丁基膦)-邻二甲苯;1,2-双(二-叔丁基磷酰甲基)苯;1,2-双(二叔丁基膦甲基)苯;alpha,alpha'双(二叔丁基膦)邻二甲苯;α,α-双(二叔丁基磷氢基)-邻二甲苯;对苯二胺-D4氘代;Alpha,Alpha-双(二叔丁基磷氢基)-邻二甲苯;Α,Α'-双(二叔丁基磷氢基)邻二甲苯;1,2-双((二-叔-丁基磷)甲基)苯;Α,Α'-BIS(DI-T-BUTYLPHOSPHINO)-O-XYLENE,MIN.97%;1,2-双(二叔丁基膦基甲基)苯;
英文别名:
1,2-Bis(di-tert-butylphosphinomethyl)benzene;1,2-Bis((di-tert-butylphosphino)methyl)benzene;ditert-butyl-[[2-(ditert-butylphosphanylmethyl)phenyl]methyl]phosphane;Phosphine,1,1'-[1,2-phenylenebis(methylene)]bis[1,1-bis(1,1-dimethylethyl)-;[1,2-phenylenebis(methylene)]bis[di(tert-butyl)phosphine];1,2-bis[(di-tert-butyl-phosphino)methyl]benzene;631922_ALDRICH;AC1NFGH4;ACMC-1C1IT;bis(di-tert-butylphosphino)-o-xylene;CTK8C6224;SC11544;α,α'-bis(di-t-butylphosphino)-o-xylene;1,2-BIS(DI-TERT-BUTYLPHOSPHINOMETHYL)BE&;ALPHA, ALPHA'-BIS(DI-T-BUTYLPHOSPHINO)-O-XYLENE;α,α'-Bis(di-t-butylphosphino)-o-xylene,96%;1,2-Bis(di-t-butylphosphinoMethyl)benzene, 98%;1,2-Bis(di-t-butylphosphinoMethyl)benzene, 97+%;α,α'-Bis(di-t-butylphosphino)-o-xylene, min. 97%;a,a'-Bis(di-t-butylphosphino)-o-xylene, min. 97%;AS-73358;1,2-Bis[(di-tert-butylphosphino)methyl]benzene;SFCNPIUDAIFHRD-UHFFFAOYSA-N;A891277;F10177;WEA95450;1,2-bis[di(t-butyl)phosphinomethyl]benzene;bis(di-t-butylphosphinomethyl) benzene;1,2-bis((di-tert-butylphosphanyl)methyl)benzene;CS-W014468;DTXSID90405525;Phosphine, 1,1'-[1,2-phenylenebis(methylene)]bis[1,1-bis(1,1-dimethylethyl)-;SY067045;121954-50-5;1,2-bis[di(tertbutyl)phosphinomethyl]benzene;FT-0744650;MFCD03094573;+/-,+/-'-Bis(di-t-butylphosphino)-o-xylene;AKOS008901083;SCHEMBL34189;DI-TERT-BUTYL({2-[(DI-TERT-BUTYLPHOSPHANYL)METHYL]PHENYL}METHYL)PHOSPHANE;SCOPOLAMINEMETHYLNITRATE;Phosphine, [1,2-phenylenebis(methylene)]bis[bis(1,1-dimethylethyl)-;ALPHA,ALPHA'-BIS(DI-T-BUTYLPHOSPHINO)-O-XYLENE;DB-009433;

标识符

MDL:
MFCD03094573
InChIKey:
SFCNPIUDAIFHRD-UHFFFAOYSA-N
Inchi:
1S/C24H44P2/c1-21(2,3)25(22(4,5)6)17-19-15-13-14-16-20(19)18-26(23(7,8)9)24(10,11)12/h13-16H,17-18H2,1-12H3
SMILES:
P(CC1C=CC=CC=1CP(C(C)(C)C)C(C)(C)C)(C(C)(C)C)C(C)(C)C

1,2-双(二叔丁基膦基甲基)苯(121954-50-5)物化性质

实验特性

  • LogP : 8.84440
  • PSA : 27.18000
  • 熔点 : 59-62°C
  • 颜色与性状 : 固体
  • 溶解性 : 未确定
  • 敏感性 : air sensitive

计算特性

  • 精确分子量 : 394.29200
  • 氢键供体数量 : 0
  • 氢键受体数量 : 0
  • 可旋转化学键数量 : 8
  • 同位素质量 : 394.29182540g/mol
  • 重原子数量 : 26
  • 复杂度 : 355
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 0
  • 不确定原子立构中心数量 : 0
  • 确定化学键立构中心数量 : 0
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 1
  • 疏水参数计算参考值(XlogP) : 4.9
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 0Ų

1,2-双(二叔丁基膦基甲基)苯(121954-50-5)安全信息

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1,2-双(二叔丁基膦基甲基)苯(121954-50-5)上下游

1,2-双(二叔丁基膦基甲基)苯(121954-50-5)相关文献

1,2-双(二叔丁基膦基甲基)苯(121954-50-5) MSDS

基础信息


Section 1: Product Identification
   Chemical Name:       alpha,alpha'-Bis(di-t-butylphosphino)-o-xylene, min. 97%    
   CAS Registry Number:       121954-50-5    
   Formula:       C6H4[CH2P(C4H9)2]2    
   EINECS Number:       none    
   Chemical Family:       organophosphine ligand    
   Synonym:       1,2-Bis(di-t-butylphosphinomethyl)benzene    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title compound       121954-50-5       100%       no data       no data    

Section 3: Hazards Identification
   Emergency Overview:       Irritating to skin, eyes and respiratory tract. May be harmful if swallowed.    
   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 specific information is 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 available on the effects of long-term exposure.    
   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:       no data    
   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: Flammable solid. 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
   Handling and Storage:       Material will degrade on exposure to air. Handle and store under an inert atmosphere of nitrogen or argon.    

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:       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 xtl.    
   Molecular Weight:       394.56    
   Melting Point:       59-62°    
   Boiling Point:       no data    
   Vapor Pressure:       no data    
   Specific Gravity:       no data    
   Odor:       no data    
   Solubility in Water:       no data    

SECTION 10: Stability and Reactivity
   Stability:       air-sensitive solid    
   Hazardous Polymerization:       none    
   Conditions to Avoid:       none    
   Incompatibility:       oxidizing agents, halogens    
   Decomposition Products:       carbon dioxide, carbon monoxide, organic fumes, and phosphorus oxides.    

SECTION 11: Toxicological Information
   RTECS Data:       No information 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 in the TSCA inventory.    
   SARA (Title 313):       Not reportable under SARA Title 313    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A