三(环戊二烯)化钆(III)

  • 基本信息
  • 物化性质
  • 安全信息
  • 毒理性
  • MSDS
  • 结构与计算化学

三(环戊二烯)化钆(III) 基本信息

中文名称:
三(环戊二烯)化钆(III) 
中文别名:
三(环戊二烯)化钆;
三(环戊二烯)钆(III) 
英文名称:
Gadolinium, tris(h5-2,4-cyclopentadien-1-yl)-
英文别名:
TRIS(CYCLOPENTADIENYL)GADOLINIUM;
Tris(cyclopentadienyl)gadolinium(III);
tris(eta5-cyclopenta-2,4-dien-1-yl)gadolinium;
Tris(cyclopentadienyl)gadolinium (III) (-Gd) (REO);
Tris(cyclopentadienyl)gadolinium ( Gd) (REO);
Tris(cyclopentadienyl)gadolinium(III) (REO) 
CAS No.:
1272-21-5
分 子 式:
C15H15Gd
分 子 量:
352.53
精确分子量:
353.04100
PSA:
0.00000
MDL:
MFCD00145476
EINECS:
215-046-9
危险品标志:
FlammableF
风险术语:
R11;R14;R15
安全术语:
S43;S7;S8
分子结构式:
SDS:
查看

三(环戊二烯)化钆(III) 物化性质

外观与性状:
灰白色粉末
熔点:
295ºC
沸点:
41.5ºC at 760 mmHg
蒸汽压:
418mmHg at 25°C
存储条件/存储方法:

保持贮藏器密封、储存在阴凉、干燥的地方,确保工作间有良好的通风或排气装置

稳定性相关:

如果遵照规格使用和储存则不会分解,避免氧化物、水分/潮湿,与水接触释放出可燃气体,与水接触产生强烈反应

其它信息:

1.       性状:粉末

2.       密度(g/mL,25):1.18

三(环戊二烯)化钆(III) 安全信息

包装等级:
III
风险类别:
4.1
危险类别码:
R11
安全说明:
43-7/8
危险标志:
F: Flammable;

三(环戊二烯)化钆(III) 毒理性

生态数据:

对是水稍微有危害的不要让未稀释或大量的产品接触地下水、水道或者污水系统,若无政府许可,勿将材料排入周围环境。

三(环戊二烯)化钆(III) MSDS


Section 1: Product Identification
   Chemical Name:       Tris(cyclopentadienyl)gadolinium (99.9%-Gd) (REO)    
   CAS Registry Number:       1272-21-5    
   Formula:       (C5H5)3Gd    
   EINECS Number:       none    
   Chemical Family:       organometallic complexes    
   Synonym:       None    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title compound       1272-21-5       100%       no data       no data    

Section 3: Hazards Identification
   Emergency Overview:       May be irritating to skin, eyes and mucous membranes.    
   Primary Routes of Exposure:       Ingestion, eyes    
   Eye Contact:       May cause slight to mild irritation of the eyes    
   Skin Contact:       May cause slight to mild irritation of the skin.    
   Inhalation:       May be irritating to the nose, mucous membranes and respiratory tract.    
   Ingestion:       Ingestion may lead to vomiting, and diarrhea.    
   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:       none    
   Autoignition Temperature:       none    
   Explosion Limits:       none    
   Extinguishing Medium:       carbon dioxide, foam or dry powder    
   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: Flammable. 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
   Keep material in a tightly sealed container. Prolonged exposure to the air will result in degradation of the
   Handling and Storage:
   product. Handle and store material 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:       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:       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:       off-white powder    
   Molecular Weight:       352.54    
   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-sensitive material    
   Hazardous Polymerization:       none    
   Conditions to Avoid:       exposure to oxygen, contact with strong oxidizing agents    
   Incompatibility:       strong oxidizing agents    
   Decomposition Products:       carbon dioxide, carbon monoxide, organic fumes, and gadolinium oxide    

SECTION 11: Toxicological Information
   RTECS Data:       No information available in RTECS.    
   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):       Flammable solids, Organic, N.O.S.    
   Hazard Class (CFR):       4.1    
   Additional Hazard Class (CFR):       NA    
   Packaging Group (CFR):       II    
   UN ID Number (CFR):       UN# 1325    
   Shipping Name (IATA):       Flammable solid, Organic, N.O.S.    
   Hazard Class (IATA):       4.1    
   Additional Hazard Class (IATA):       NA    
   Packaging Group (IATA):       II    
   UN ID Number (IATA):       UN# 1325    

SECTION 15: Regulatory Information
   TSCA:       not listed on the TSCA inventory    
   SARA (Title 313):       Not reportable under SARA Title (313).    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A

三(环戊二烯)化钆(III) 分子结构与计算化学数据

分子结构数据

1、摩尔折射率:无可用的

2、摩尔体积(cm3/mol):无可用的

3、等张比容(90.2K):无可用的

4、表面张力(dyne/cm):无可用的

5、介电常数:无可用的

6、极化率(10-24cm3):无可用的

7、单一同位素质量:353.041475 Da

8、标称质量:353 Da

9、平均质量:352.5296 Da

计算化学数据

1、   氢键供体数量:0

2、   氢键受体数量:3

3、   可旋转化学键数量:0

4、   拓扑分子极性表面积(TPSA):0

5、   重原子数量:16

6、   表面电荷:0

7、   复杂度:86.8

8、   同位素原子数量:0

9、   确定原子立构中心数量:0

10、   不确定原子立构中心数量:0

11、   确定化学键立构中心数量:0

12、   不确定化学键立构中心数量:0

13、   共价键单元数量:4

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