460092-03-9 (三己基(四癸基)膦 双(三氟甲基磺酰)氨,Trihexyl(Tetradecyl)Phosphonium Bis(Trifluoromethyl)SulfonylAzanide)

CAS号:
460092-03-9
中文名称:
三己基(四癸基)膦 双(三氟甲基磺酰)氨
英文名称:
Trihexyl(Tetradecyl)Phosphonium Bis(Trifluoromethyl)SulfonylAzanide
安全信息:
分子式:
C34H68F6NO4PS2
分子量:
764.00200

三己基(四癸基)膦 双(三氟甲基磺酰)氨(460092-03-9)名称与标识符

名称

中文别名:
三己基(四癸基)膦 双(三氟甲基磺酰)氨;三己基十四烷基膦双(三氟甲基磺酰基)酰胺;十四烷基三己基膦双(三氟甲基磺酰基)酰胺;
英文别名:
bis(trifluoromethylsulfonyl)azanide,trihexyl(tetradecyl)phosphanium;[P6,6,6,14][NTf2];[PR4][Tf2N];[TDTHP][NTf2];[THTDP][NTf2];Tetradecyltrihexylphosphonium bis(trifluoromethylsulfonyl)amide;tetradecyltrihexylphosphonium NTf2;Trihexyltetradecylphosphonium bis(trifluoromethylsulfonyl)amide;Trihexyl(Tetradecyl)Phosphonium Bis(Trifluoromethyl)SulfonylAzanide;AKOS015913634;Trihexyltetradecylphosphonium bis(trifluoromethylsulfonyl)amide, >=95.0%;CHEMBL3183021;MFCD04117695;AT25631;CAS-460092-03-9;Trihexyl(tetradecyl)phosphonium bis(trifluoromethanesulfonyl)amide;Phosphonium, trihexyltetradecyl-, salt with 1,1,1-trifluoro-N-((trifluoromethyl)sulfonyl)methanesulfonamide (1:1);DTXCID7029160;NSC747251;BISTRIFLYLIMIDE ANION; TRIHEXYL(TETRADECYL)PHOSPHANIUM;NSC-747251;bis(trifluoromethylsulfonyl)azanide;trihexyl(tetradecyl)phosphanium;NCGC00260162-01;CS-0452752;Phosphonium, trihexyltetradecyl-, salt with 1,1,1-trifluoro-N-[(trifluoromethyl)sulfonyl]methanesulfonamide (1:1);Trihexyl(tetradecyl)Phosphonium Bis (Trifluoromethylsulfonylmide);TRIHEXYL(TETRADECYL)PHOSPHONIUM BIS(TRIFLUOROMETHYLSULFONYL)IMIDE;NSC 747251;Tox21_202614;SCHEMBL451878;Trihexyltetradecylphosphonium bis(trifluoromethylsulfonyl)imide;460092-03-9;DTXSID1049304;TRIHEXYL(TETRADECYL)PHOSPHONIUM BIS((TRIFLUOROMETHYL)SULFONYL)AMIDE;

标识符

MDL:
MFCD04117695
InChIKey:
HYNYWFRJHNNLJA-UHFFFAOYSA-N
Inchi:
InChI=1S/C32H68P.C2F6NO4S2/c1-5-9-13-17-18-19-20-21-22-23-24-28-32-33(29-25-14-10-6-2,30-26-15-11-7-3)31-27-16-12-8-4;3-1(4,5)14(10,11)9-15(12,13)2(6,7)8/h5-32H2,1-4H3;/q+1;-1
SMILES:
CCCCCCCCCCCCCC[P+](CCCCCC)(CCCCCC)CCCCCC.C(F)(F)(F)S(=O)(=O)[N-]S(=O)(=O)C(F)(F)F

三己基(四癸基)膦 双(三氟甲基磺酰)氨(460092-03-9)物化性质

实验特性

  • LogP : 15.66690
  • PSA : 98.63000
  • 闪点 : 华氏:125.6 °F
    摄氏:52 °C
  • 颜色与性状 : 无可用
  • 溶解性 : 无可用
  • 密度 : 1.07 g/mL at 20 °C(lit.)

计算特性

  • 精确分子量 : 763.42300
  • 氢键供体数量 : 0
  • 氢键受体数量 : 5
  • 可旋转化学键数量 : 32
  • 同位素质量 : 763.42315797g/mol
  • 重原子数量 : 48
  • 复杂度 : 693
  • 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 : 2
  • 疏水参数计算参考值(XlogP) : 无可用
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 69.3

三己基(四癸基)膦 双(三氟甲基磺酰)氨(460092-03-9)安全信息

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三己基(四癸基)膦 双(三氟甲基磺酰)氨(460092-03-9) MSDS

基础信息


Section 1: Product Identification
   Chemical Name:       Trihexyl(tetradecyl)phosphonium bis(trifluoromethanesulfonyl)amide, min. 97% CYPHOS IL 109    
   CAS Registry Number:       460092-03-9    
   Formula:       [(C6H13)3(C14H29)P]+[(CF3SO2)N]-    
   EINECS Number:       none    
   Chemical Family:       organophosphine compound    
   Synonym:       CYPHOSIL 109    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title compound       460092-03-9       100%       2.5mg(F)/m3       2.5mg(F)/m3    

Section 3: Hazards Identification
   Emergency Overview:       Irritating to skin, eyes and respiratory tract. May be harmful if swallowed.    
   Primary Routes of Exposure:       Ingestion, skin    
   Eye Contact:       Causes mild to moderate irritation to the eyes.    
   Skin Contact:       Causes mild to moderate irritation of the skin.    
   Inhalation:       As a liquid aerosol, 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. May be harmful if swallowed.    
   Product contains fluorine which, under certain conditions of use, decomposition or metabolism, may generate
   Chronic Health Affects:       fluoride ion causing nausea, vomiting, labored breathing, hypocalcaemia, deterioration of bone and tooth    
   structure and kidney and liver damage.
   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.    
   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 and       If 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 hazard.

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
   Handling and Storage:       Keep container tightly closed. Store in a cool, dry 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:       colorless liq.    
   Molecular Weight:       764    
   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:       strong oxidizing agents    
   Decomposition Products:       carbon monoxide, phosphorous pentoxide, sulfur and nitrogen oxides, hydrofluoric acid 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