181418-64-4 (三(2,2,6,6-四甲基-3,5-庚二酮酸)钛(III),Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium (III) [Ti(TMHD)3])

CAS号:
181418-64-4
中文名称:
三(2,2,6,6-四甲基-3,5-庚二酮酸)钛(III)
英文名称:
Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium (III) [Ti(TMHD)3]
分子式:
C33H60O6Ti
分子量:
600.692912101746

三(2,2,6,6-四甲基-3,5-庚二酮酸)钛(III)(181418-64-4)名称与标识符

名称

中文别名:
三(2,2,6,6-四甲基-3,5-庚二酮酸)钛(III);(S)-N-(2,2-二氟亚乙基)-1-苯基乙胺;3-氯-2-(11-二氟丁-3烯基)-6-甲氧基喹喔啉;三(2,2,6,6-四甲基-3,5-庚二酮酸)钛;钇(Ⅲ)(三甘醇二甲醚添加物);三(2,2,6,6-四甲基-3,5-庚二酮)钛;三(2,2,6,6-四甲基-3,5-HEPTANEDIONATO)钛;
英文别名:
Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium (III) [Ti(TMHD)3];(Z)-2,2,6,6-tetramethyl-5-oxo-hept-3-en-3-olate;titanium(+3) cation;Tris(2,2,6,6-tetraMethyl-3,5-heptanedionato)titaniuM(III);TI(TMHD)3;Tris-(2,2,6,6-tetramethyl-3,5-heptandionato)titanium(III);Tris(2,2,6,6tetramethyl-3,5-heptanedionato)yttrium(Ⅲ)(Triglyme Adduct);TRIS(2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATO)TITANIUM (III);Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium(III), min. 97% [Ti(TMHD)3];Titatnium(III)-DPM;(Z)-2,2,6,6-tetramethyl-5-oxohept-3-en-3-olate;titanium(3+);181418-64-4;Titanium, tris(2,2,6,6-tetramethyl-3,5-heptanedionato-kappaO3,kappaO5)-, (OC-6-11)-;MFCD00145466;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;titanium;Titanium,tris(2,2,6,6-tetramethyl-3,5-heptanedionato-ko3,ko5)-,(oc-6-11)-;

标识符

MDL:
MFCD00145466
InChIKey:
GDCBFXOQZJSCHZ-LWTKGLMZSA-N
Inchi:
1S/3C11H20O2.Ti/c3*1-10(2,3)8(12)7-9(13)11(4,5)6;/h3*7,12H,1-6H3;/b3*8-7-;
SMILES:
[Ti].O/C(=C\C(C(C)(C)C)=O)/C(C)(C)C.O/C(=C\C(C(C)(C)C)=O)/C(C)(C)C.O/C(=C\C(C(C)(C)C)=O)/C(C)(C)C

三(2,2,6,6-四甲基-3,5-庚二酮酸)钛(III)(181418-64-4)物化性质

实验特性

  • LogP : 9.03750
  • PSA : 78.90000
  • 沸点 : 75°C 0,1mm
  • 闪点 : 75°C/0.1mm subl.
  • 颜色与性状 : 紫色晶体
  • 溶解性 : 不能溶解于水的
  • 敏感性 : Hygroscopic
  • 密度 : g/cm3

计算特性

  • 精确分子量 : 597.36300
  • 氢键供体数量 : 0
  • 氢键受体数量 : 6
  • 可旋转化学键数量 : 9
  • 同位素质量 : 597.3634552g/mol
  • 重原子数量 : 40
  • 复杂度 : 199
  • 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 : 3
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 4
  • 拓扑分子极性表面积 : 120Ų

三(2,2,6,6-四甲基-3,5-庚二酮酸)钛(III)(181418-64-4)国际标准相关数据

EINECS:

三(2,2,6,6-四甲基-3,5-庚二酮酸)钛(III)(181418-64-4)推荐厂家 更多厂家(4)

公司名称手机号/电话联系人QQ微信询单
上海瀚思化工有限公司 18939883912
021-34536277
顾经理 3003949364
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上海麦克林生化科技股份有限公司 15221275939
021-50706066
沈经理 269348414
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上海源叶生物科技有限公司 15026964105
15026964105
汤思磊 2881489226
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上海阿拉丁生化科技股份有限公司 13167063860
13167063860
阿拉丁 3004013043
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三(2,2,6,6-四甲基-3,5-庚二酮酸)钛(III)(181418-64-4)参考资料

Reaxys RN:
PubChem CID:

三(2,2,6,6-四甲基-3,5-庚二酮酸)钛(III)(181418-64-4) MSDS

基础信息


Section 1: Product Identification
   Chemical Name:       Tris(2,2,6,6-tetramethyl-3,5-heptanedionato)titanium(III), min. 97% Ti(TMHD)3    
   CAS Registry Number:       181418-64-4    
   Formula:       Ti(C11H19O2)3    
   EINECS Number:       none    
   Chemical Family:       metal beta-diketonate complexes    
   Synonym:       Dipivaloylmethane, titanium complex    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title Compound       181418-64-4       100%       no data       no data    

Section 3: Hazards Identification
   No reports could be found indicating specific hazards are associated with this material. Toxicity is probably
   Emergency Overview:
   minimal.
   Primary Routes of Exposure:       Ingestion    
   Eye Contact:       May cause slight to mild irritation of the eyes.    
   Skin Contact:       May cause slight to mild irritation of the skin.    
   Inhalation:       (If dust) May be irritating to the nose, mucous membranes and respiratory tract.    
   Ingestion:       No information on the physiological effects of ingestion.    
   Acute Health Affects:       May be irritating to skin, eyes and respiratory tract.    
   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 soap and water. Remove contaminated clothes if necessary. Seek medical
   Skin Exposure:
   assistance if 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.
   Ingestion:       Seek medical attention immediately. Keep the victim calm. Give the victim water (only if conscious).    

SECTION 5: Fire Fighting Measures
   Flash Point:       not applicable    
   Autoignition Temperature:       none    
   Explosion Limits:       none    
   Extinguishing Medium:       carbon dioxide, dry powder or foam    
   If involved in a fire, fire fighters should be equipped with a NIOSH approved positive pressure self-contained
   Special Fire Fighting Procedures:
   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
   Store under argon in a tightly sealed container in a dry place. If container is left open, air and moisture will
   Handling and Storage:
   degrade this material.

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 appropriate chemical resistant gloves and protective clothing.    
   Ventilation:       Material may form a fine dust. If possible, handle the material in an efficient fume hood.    
   If in form of fine dust and ventilation is not available a respirator should be worn. The use of respirators
   Respirator:
   requires a 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:       purple xtl.    
   Molecular Weight:       597.7    
   Melting Point:       no data    
   Boiling Point:       subl. 75°C /0.1mm    
   Vapor Pressure:       no data    
   Specific Gravity:       no data    
   Odor:       none    
   Solubility in Water:       insoluble    

SECTION 10: Stability and Reactivity
   Stability:       air sensitive, moisture sensitive    
   Hazardous Polymerization:       no hazardous polymerization    
   Conditions to Avoid:       exposure to air and moisture.    
   Incompatibility:       oxidizing agents    
   Decomposition Products:       Carbon dioxide, carbon monoxide, organic vapors, and metal oxides and carbonates.    

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):       Title compound not listed.    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A