141096-35-7 (2-(BOC-氨基)-3-甲基吡啶,(R)-2-(Diphenylphosphino)-1-phenylethanamine)

CAS号:
141096-35-7
中文名称:
2-(BOC-氨基)-3-甲基吡啶
英文名称:
(R)-2-(Diphenylphosphino)-1-phenylethanamine
分子式:
C20H20NP
分子量:
305.353265762329

2-(BOC-氨基)-3-甲基吡啶(141096-35-7)名称与标识符

名称

中文别名:
(R)-2 - (二苯基膦)- 1 -苯乙胺;2-(BOC-氨基)-3-甲基吡啶;
英文别名:
(R)-2-(Diphenylphosphino)-1-phenylethanamine;(R)-2-(Diphenylphosphino)-1-phenylethylamine;141096-35-7;DB-200473;DTXSID30855641;D94513;CS-W014533;SCHEMBL17513134;(R)-2-(Diphenylphosphino)-1-phenylethylamine, min. 97%;A885707;Benzenemethanamine, alpha-[(diphenylphosphino)methyl]-, (R)- (9CI);(1R)-2-diphenylphosphanyl-1-phenylethanamine;[(2R)-2-AMINO-2-PHENYLETHYL]DIPHENYLPHOSPHANE;(1R)-2-(Diphenylphosphanyl)-1-phenylethan-1-amine;(R)-2-(Diphenylphosphino)-1-phenylethylamine,min. 97%;(R)-2-(diphenylphosphanyl)-1-phenylethan-1-amine;(R)-2-(Diphenylphosphino)-1-phenylethylamine, min. 97per cent;MFCD17013988;

标识符

MDL:
MFCD17013988
InChIKey:
OTNYDYNCOCRMDG-FQEVSTJZSA-N
Inchi:
1S/C20H20NP/c21-20(17-10-4-1-5-11-17)16-22(18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16,21H2/t20-/m0/s1
SMILES:
P(C1C=CC=CC=1)(C1C=CC=CC=1)C[C@@H](C1C=CC=CC=1)N

2-(BOC-氨基)-3-甲基吡啶(141096-35-7)物化性质

实验特性

  • LogP : 4.51960
  • PSA : 39.61000
  • 敏感性 : air sensitive

计算特性

  • 精确分子量 : 305.13300
  • 氢键供体数量 : 1
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 5
  • 同位素质量 : 305.133336640g/mol
  • 重原子数量 : 22
  • 复杂度 : 283
  • 同位素原子数量 : 0
  • 确定原子立构中心数量 : 1
  • 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) : 3.6
  • 拓扑分子极性表面积 : 26Ų

2-(BOC-氨基)-3-甲基吡啶(141096-35-7)上下游

2-(BOC-氨基)-3-甲基吡啶(141096-35-7) MSDS

基础信息


Section 1: Product Identification
   Chemical Name:       (R)-2-(Diphenylphosphino)-1-phenylethylamine, min. 97%    
   CAS Registry Number:       141096-35-7    
   Formula:       C26H24NP    
   EINECS Number:       none    
   Chemical Family:       organophosphine ligand    
   Synonym:       none    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title compound       141096-35-7       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 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:       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:       no data    
   Autoignition Temperature:       no data    
   Explosion Limits:       no data    
   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 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
   Store in a tightly sealed container under an inert atmosphere of nitrogen or argon. Keep in a cool, dry, well
   Handling and Storage:
   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:       white solid    
   Molecular Weight:       381.43    
   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 sensitive    
   Hazardous Polymerization:       no hazardous polymerization    
   Conditions to Avoid:       prolonged exposure to air    
   Incompatibility:       strong oxidizing agents    
   Decomposition Products:       carbon monoxide, carbon dioxide, nitrogen oxides, phosphorous 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 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 313.    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A