34872-98-5 (双(2,2,6,6 - 四甲基-3,5 - 庚二酮)二氧化钼(VI),Molybdenum,dioxobis(2,2,6,6-tetramethyl-3,5-heptanedionato-kO,kO')-, (OC-6-21)- (9CI))

基本信息

CAS号:
34872-98-5
中文名称:
双(2,2,6,6 - 四甲基-3,5 - 庚二酮)二氧化钼(VI)
英文名称:
Molybdenum,dioxobis(2,2,6,6-tetramethyl-3,5-heptanedionato-kO,kO')-, (OC-6-21)- (9CI)
分子式:
C22H40MoO6
分子量:
496.489410400391

名称与标识

名称

中文别名:
双(2,2,6,6 - 四甲基-3,5 - 庚二酮)二氧化钼(VI);
英文别名:
Molybdenum,dioxobis(2,2,6,6-tetramethyl-3,5-heptanedionato-kO,kO')-, (OC-6-21)- (9CI);MOLYBDENUM (VI) DIOXIDE BIS(2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATE);MOLYBDENUM(VI) OXIDE BIS(2,2,6,6-TETRAMETHYL-3,5-HEPTANEDIONATE);Molybdenum(Vi)OxideBis(2,2,6,6-Tetramethyl-3,5-Hepta;Bis-(2,2,6,6-tetramethyl-3,5-heptanedionato-O,O')-molybdenum dioxide;Molybdenum(VI)dioxidebis(2,2,6,6-tetramethyl-3,5-heptanedionate),min.[O2Mo(TMHD)2];Molybdenumdioxidebistetramethylheptanedionatem;Molybdenum(VI) dioxide bis(2,2,6,6-tetramethyl-3,5-heptanedionate);34872-98-5;dioxomolybdenum;(Z)-5-hydroxy-2,2,6,6-tetramethylhept-4-en-3-one;MFCD00269827;

标识符

MDL:
MFCD00269827
InChIKey:
FLPSXHSSVOJARZ-KKUWAICFSA-N
Inchi:
1S/2C11H20O2.Mo.2O/c2*1-10(2,3)8(12)7-9(13)11(4,5)6;;;/h2*7,12H,1-6H3;;;/b2*8-7-;;;
SMILES:
[Mo](=O)=O.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

物化性质

实验特性

  • LogP : 5.78740
  • PSA : 86.74000
  • 熔点 : 129-131°C
  • 颜色与性状 : 未确定
  • 溶解性 : 未确定
  • 敏感性 : moisture sensitive

计算特性

  • 精确分子量 : 496.17200
  • 氢键供体数量 : 2
  • 氢键受体数量 : 6
  • 可旋转化学键数量 : 6
  • 同位素质量 : 498.187893g/mol
  • 重原子数量 : 29
  • 复杂度 : 581
  • 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 : 2
  • 不确定化学键立构中心数量 : 0
  • 共价键单元数量 : 3
  • 拓扑分子极性表面积 : 109Ų

安全信息

国际标准相关数据

EINECS:

双(2,2,6,6 - 四甲基-3,5 - 庚二酮)二氧化钼(VI)(34872-98-5)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
询单
上海源叶生物科技有限公司 15026964105
15026964105
汤思磊 2881489226
询单
上海阿拉丁生化科技股份有限公司 13167063860
13167063860
阿拉丁 3004013043
询单
北京浩克科技有限公司 张经理询单

参考资料

Reaxys RN:
PubChem CID:

双(2,2,6,6 - 四甲基-3,5 - 庚二酮)二氧化钼(VI)(34872-98-5) MSDS

基础信息


Section 1: Product Identification
   Chemical Name:       Molybdenum (VI) dioxide bis(2,2,6,6-tetramethyl-3,5-heptanedionate), min. 98% [O2Mo(TMHD)2]    
   CAS Registry Number:       34872-98-5    
   Formula:       MoO2(C11H19O2)2    
   EINECS Number:       none    
   Chemical Family:       metal beta-diketonate complexes    
   Synonym:       Molybdenum oxo TMHD    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title Compound       34872-98-5       100%       10mg/m3 (as       15mg/m3 (as    

Section 3: Hazards Identification
   Emergency Overview:       No particular hazard associated with this material.    
   Primary Routes of Exposure:       Ingestion, Inhalation of dust.    
   Eye Contact:       May cause slight to mild irritation of the eyes.    
   Skin Contact:       May cause slight to mild irritation of the skin.    
   Inhalation:       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 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:       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
   Handling and Storage:       Store in a sealed container. Keep away from heat and moisture.    

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:       yellow xtl.    
   Molecular Weight:       494.48    
   Melting Point:       129-131°    
   Boiling Point:       no data    
   Vapor Pressure:       no data    
   Specific Gravity:       no data    
   Odor:       none    
   Solubility in Water:       insoluble    

SECTION 10: Stability and Reactivity
   Stability:       moisture sensitive solid    
   Hazardous Polymerization:       no hazardous polymerization    
   Conditions to Avoid:       none    
   Incompatibility:       none    
   Decomposition Products:       Carbon dioxide, carbon monoxide, organic vapors, soot, 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