二(乙基环戊二烯基)锰(II)

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

二(乙基环戊二烯基)锰(II) 基本信息

中文名称:
二(乙基环戊二烯基)锰(II) 
中文别名:
二(乙基环戊二烯基)锰(II);
双(乙基环戊二烯基)锰;
双(乙基环戊二烯基)锰(II) 
英文名称:
bis(ethylcyclopentadienyl)manganese
英文别名:
2-ethylcyclopenta-1,3-diene,manganese(2+);
Manganocene,1,1'-diethyl;
1,1'-Diethylmanganocene 
CAS No.:
101923-26-6
分 子 式:

C14H18Mn

分 子 量:
241.23
精确分子量:
241.07900
PSA:
0.00000
MDL:
MFCD01862452
InChI:
The Key: NMGMAOIYXASREJ-UHFFFAOYSA-N
危险品标志:

FlammableF;IrritantXi;

风险术语:

R17;R36/37/38

安全术语:

S26

分子结构式:
SDS:
查看

二(乙基环戊二烯基)锰(II) 物化性质

沸点:
~80ºC(lit.)
闪点:
230 °F
存储条件/存储方法:

密封储存,储存于阴凉、干燥的库房。远离热源,火花,火焰。常用氮气保护。

稳定性相关:

常温常压下稳定,避免与空气,水分,强氧化剂接触。

其它信息:

1.      性状:液体

2.      密度(g/mL,20℃):未确定

3.      相对蒸汽密度(g/mL,空气=1):未确定

4.      熔点(ºC):未确定

5.      沸点(ºC,常压):80

6.      沸点(ºC,1.5mmHg):未确定

7.      折射率(n20/D):未确定

8.      闪点(ºC):110

9.      比旋光度(º):未确定

10.   自燃点或引燃温度(ºC):未确定

11.   蒸气压(mmHg,20ºC):未确定

12.   饱和蒸气压(kPa,25ºC):未确定

13.   燃烧热(KJ/mol):未确定

14.   临界温度(ºC):未确定

15.   临界压力(KPa):未确定

16.   油水(辛醇/水)分配系数的对数值:未确定

17.   爆炸上限(%,V/V):未确定

18.   爆炸下限(%,V/V):未确定

19.   溶解性:未确定

二(乙基环戊二烯基)锰(II) 安全信息

危险类别码:
R17
安全说明:
26
安全标志:
S26:万一接触眼睛,立即使用大量清水冲洗并送医诊治。
危险标志:
F: Flammable;Xi: Irritant;

二(乙基环戊二烯基)锰(II) MSDS


Section 1: Product Identification
   Bis(ethylcyclopentadienyl)manganese, min. 98%, 25-0210, contained in 50 ml Swagelok® cylinder (96-1070)
   Chemical Name:
   for CVD/ALD
   CAS Registry Number:       101923-26-6    
   Formula:       [(C2H5)C5H4]2Mn    
   EINECS Number:       none    
   Chemical Family:       metallocene    
   Synonym:       none    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title compound       101923-26-6       100%       0.2mg/m3 (as Mn)       5mg/m3 (as Mn-    

Section 3: Hazards Identification
   May be irritating to, skin, eyes and mucous membranes. May be harmful if swallowed. Some manganese
   Emergency Overview:
   compounds are known to affect the central nervous system. Possible risk of irreversible effects.
   Primary Routes of Exposure:       Inhalation and ingestion    
   Eye Contact:       May cause slight to mild irritation of the eyes.    
   Skin Contact:       May cause slight to mild irritation of the skin.    
   Vapor or mist may be irritating to the nose, mucous membranes and respiratory tract. May cause chronic
   Inhalation:
   health problems.
   Ingestion:       No information available on the physiological effects of ingestion. May be harmful if swallowed.    
   Acute Health Affects:       May be irritaitng to the nose, mucous membranes and respiratory tract.    
   Prolonged exposure to manganese containing vapor or mist may produce manganese pneumonitis and
   Chronic Health Affects:       manganese poisoning. Symptoms include sleepiness, weakness and emotional disturbances. Equivocal    
   studies have shown manganese may decrease fertility in men. Possible risk of irreversible 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, 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 toxic and corrosive fumes.    
   Decomposion Products:
   Unusual Fire or Explosion Hazards: Highly flammable. Formation of explosive air/dust mixtures is possible.

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
   Handle and store the material under an inert atmosphere of nitrogen or argon. Keep in a cool, dry
   Handling and Storage:
   well-ventilated area. Prolongrd exposure to air or moisture will result in degradation of the product.

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:       dark red liq.    
   Molecular Weight:       241.23    
   Melting Point:       not applicable    
   Boiling Point:       no data    
   Vapor Pressure:       0.1 torr @ 50-65°    
   Specific Gravity:       no data    
   Odor:       none    
   Solubility in Water:       reacts with water    

SECTION 10: Stability and Reactivity
   Stability:       air sensitive, moisture sensitive    
   Hazardous Polymerization:       no hazardous polymerization    
   contact with moisture and oxygen. Keep away from heat and ignition sources including open flame and
   Conditions to Avoid:
   electostatic discharge.
   Incompatibility:       air, oxidizing agents, halogens, protoc agents    
   Decomposition Products:       Carbon dioxide, carbon monoxide, organic fumes and manganese oxide.    

SECTION 11: Toxicological Information
   RTECS Data:       No information available from the RTECS files.    
   Carcinogenic Effects:       no data    
   Mutagenic Effects:       Possible mutagen (as Mn)    
   Tetratogenic Effects:       no data    

SECTION 12: Ecological Information
   Ecological Information:       No information available.    

SECTION 13: Disposal Considerations
   Disposal:       Dispose of this material 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 in the TSCA inventory    
   SARA (Title 313):       See Category code N450 for reporting    
   Second Ingredient:       none    


SECTION 16 - ADDITIONAL INFORMATION
N/A

二(乙基环戊二烯基)锰(II) 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:241.0789 Da

8、标称质量:241 Da

9、平均质量:241.2308 Da

计算化学数据

1、   疏水参数计算参考值(XlogP):

2、   氢键供体数量:0

3、   氢键受体数量:8

4、   可旋转化学键数量:2

5、   互变异构体数量:

6、   拓扑分子极性表面积(TPSA):0

7、   重原子数量:15

8、   表面电荷:-8

9、   复杂度:250

10、同位素原子数量:0

11、确定原子立构中心数量:0

12、不确定原子立构中心数量:0

13、确定化学键立构中心数量:0

14、不确定化学键立构中心数量:0

15、共价键单元数量:3

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