2-乙基己酸镍,乙基乙酸溶液

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

2-乙基己酸镍,乙基乙酸溶液 基本信息

中文名称:
2-乙基己酸镍,乙基乙酸溶液 
中文别名:
2-乙基己酸镍,乙基乙酸溶液;
2-乙基己酸镍 
英文名称:
Hexanoic acid,2-ethyl-, nickel(2+) salt (2:1)
英文别名:
Hexanoic acid, 2-ethyl-, nickel(2+) salt (2:1);
Hexanoic acid, 2-ethyl-, nickel(2+) salt (8CI,9CI);
NUSA Ni;
Nickel (II) ethylhexanoate;
Nickel 2-ethylhexanoate;
Nickel 2-ethylhexoate;
Nickel bis(2-ethylhexanoate);
Nickel(II) 2-ethylhexanoate 
CAS No.:
4454-16-4
分 子 式:
C8H16O2.1/2Ni
分 子 量:
345.13
精确分子量:
346.16541
PSA:
52.60000
MDL:
MFCD00014002
EINECS:
224-699-9
危险品标志:
T
风险术语:
R45R20/21/22R36/37/38
安全术语:
S26S45S53S36/S37/S39
分子结构式:
SDS:
查看

2-乙基己酸镍,乙基乙酸溶液 物化性质

密度:
0.96 g/mL at 25 °C(lit.)
沸点:
228ºC at 760mmHg
闪点:
116.6ºC
存储条件/存储方法:

 避光,通风干燥处,密封保存

稳定性相关:

常温常压下稳定

其它信息:

1.       性状:绿色粘状

2.       密度:不确定

3.       相对蒸汽密度(g/mL,空气=1):不确定

4.       熔点(ºC):不确定

5.       沸点(ºC,常压):不确定

6.       沸点(ºC,12mmHg):不确定

7.       折射率:不确定

8.       闪点(ºC):不确定

9.       比旋光度(º):不确定

10.    自燃点或引燃温度(ºC):不确定

11.    蒸气压(kPa,25ºC):不确定

12.    饱和蒸气压(kPa,60ºC):不确定

13.    燃烧热(KJ/mol):不确定

14.    临界温度(ºC):不确定

15.    临界压力(KPa):不确定

16.    油水(辛醇/水)分配系数的对数值:不确定

17.    爆炸上限(%,V/V):不确定

18.    爆炸下限(%,V/V):不确定

19.    溶解性:不确定

2-乙基己酸镍,乙基乙酸溶液 安全信息

危险类别码:
45-20/21/22-36/37/38
安全说明:
53-26-36/37/39-45
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。
S45:出现意外或者感到不适,立刻到医生那里寻求帮助(最好带去产品容器标签)。
S53:避免暴露——使用前先阅读专门的说明。
:
危险标志:
T: Toxic;

2-乙基己酸镍,乙基乙酸溶液 毒理性

毒理学数据:

主要的刺激性影响

在皮肤上面:刺激皮肤和粘膜

   在眼睛上面:刺激的影响

   过敏作用:通过皮肤接触可能造成敏化作用

生态数据:

通常对水是不危害的,若无政府许可,勿将材料排入周围环境

2-乙基己酸镍,乙基乙酸溶液 MSDS


Section 1: Product Identification
   Chemical Name:       Nickel (II) 2-ethylhexanoate,78% in 2-ethylhexanoic acid (10-15% Ni)    
   CAS Registry Number:       4454-16-4    
   Formula:       Ni[OOCCH(C2H5)C4H9]2    
   EINECS Number:       244-699-9    
   Chemical Family:       metal carboxylate    
   Synonym:       2-Ethylcaproic acid, nickel in 2-Ethylcaproic acid    

Section 2: Composition and Information on Ingredients
   Ingredient       CAS Number       Percent       ACGIH (TWA)       OSHA (PEL)    
   Title Compound       4454-16-4       78%       0.2mg/m3 (as Ni)       1mg/m3 (as Ni)    
   2-ethylhexanoic acid       149-57-5       21%       no data       no data    

Section 3: Hazards Identification
   2-ethyl hexanoic acid is severely irritating to eyes, skin and respiratory tract, and causes drowsiness. May
   Emergency Overview:
   cause sensitization by skin contact and may cause cancer.
   Primary Routes of Exposure:       Ingestion, eyes, inhalation, skin    
   Eye Contact:       Causes severe irritation of the eyes.    
   Skin Contact:       Causes moderate to severe irritation of the skin. May cause sensitization by skin contact.    
   Inhalation:       Vapor will severely irritate the nose, mucous membranes and respiratory tract, and cause drowsiness.    
   Ingestion:       Ingestion may cause gastrointestinal distress, dizziness, weakness, and drowsiness.    
   Acute Health Affects:       Irritating to skin, eyes and respiratory tract. May cause sensitization by skin contact.    
   Prolonged exposure to 2-ethylhexanoic acid may damage the liver. Long term exposure to nickel and nickel
   Chronic Health Affects:
   compounds may lead to skin irritation and dermatitis. May cause cancer.
   NTP:       Yes    
   IARC:       Yes    
   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:       155 °F    
   Autoignition Temperature:       no data    
   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
   Eliminate all ignition sources. Small spills may be adsorbed into diatomaceous earth, sand, or other suitable
   Spill and Leak Procedures:
   adsorbent, 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 vapor. 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:       Material may form a vapor. 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:       viscous liq.    
   Molecular Weight:       345.13    
   Melting Point:       no data    
   Boiling Point:       no data    
   Vapor Pressure:       no data    
   Specific Gravity:       1.08    
   Odor:       organic odor    
   Solubility in Water:       insoluble    

SECTION 10: Stability and Reactivity
   Stability:       air and moisture stable liquid    
   Hazardous Polymerization:       no hazardous polymerization    
   Conditions to Avoid:       none    
   Incompatibility:       oxidizing agents, bases    
   Decomposition Products:       Carbon dioxide, carbon monoxide, organic vapors, and metal oxides and carbonates.    

SECTION 11: Toxicological Information
   No information available in the RTECS files. 2-Ethylhexanoic acid: Eye (rabbit) Draize: 20mg Severe; Oral
   RTECS Data:       (rat) LD50:3g/kg; Inhalation (rat) LC: >400 ppm/6H; Skin (rabbit) LD50: 1260 microliter/kg; Oral (rat) TDLo:    
   8800 mg/kg/2W-1 somnolence; Oral (rat) Reproductive: 1803 mg.Kg developmental abnormalities.
   Carcinogenic Effects:       Carcinogen (as Ni)    
   Mutagenic Effects:       none    
   Tetratogenic Effects:       2-Ethylhexanoic acid: reproductive effector.    

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:       Listed in the TSCA inventory.    
   SARA (Title 313):       Title compound: See Category Code N495 for reporting.    
   Second Ingredient:       2-ethylhexanoic acid (149-57-5) listed TSCA    


SECTION 16 - ADDITIONAL INFORMATION
N/A

2-乙基己酸镍,乙基乙酸溶液 分子结构与计算化学数据

计算化学数据

1.疏水参数计算参考值(XlogP):无

2.氢键供体数量:0

3.氢键受体数量:4

4.可旋转化学键数量:8

5.互变异构体数量:无

6.拓扑分子极性表面积80.3

7.重原子数量:21

8.表面电荷:0

9.复杂度:93.9

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:2

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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