19530-02-0

19530-02-0结构式
19530-02-0结构式

化源商城直购

中文名 六氟-乙酰丙酮锆
英文名 zirconium hexafluoroacetylacetonate
英文别名 MFCD00079660
zirconium hexafluoroacetonylacetonate
ZIRCONIUM(IV) HEXAFLUORO-2,4-PENTANEDIONATE
ZirconiuM(IV) hexafluoroacetylacetonate,Zr(CF3COCHCOCF3)4
Zirconium(lV) hexafluoroacetylacetonate
ZIRCONIUM HEXAFLUOROPENTANEDIONATE
ZIRCONIUM(IV)HEXAFLUOROACETYLACETONATE
Zirconiumhexafluoroacetylacetonate
沸点 225ºC
熔点 41-43ºC
分子式 C20H4F24O8Zr
分子量 919.42700
闪点 225ºC
精确质量 917.85700
PSA 105.20000
LogP 8.17960
外观性状 Crystalline | Off-white
蒸汽压 131mmHg at 25°C
储存条件

常温密闭避光,通风干燥

稳定性

常温常压下稳定

避免的物料:氧化物。溶于苯、乙醚等有机溶剂。
计算化学

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:32

4.可旋转化学键数量:0

5.互变异构体数量:5

6.拓扑分子极性表面积137

7.重原子数量:53

8.表面电荷:0

9.复杂度:1010

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:5

更多

1. 性状:无色晶体,具吸湿性。

2. 密度(g/mL,25/4℃):不确定

3. 相对蒸汽密度(g/mL,空气=1):不确定

4. 熔点(ºC):41-43

5. 沸点(ºC,常压):225

6. 沸点(ºC, 5.2kPa):不确定

7. 折射率:不确定

8. 闪点(ºC):225

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


Section 1: Product Identification
Chemical Name:Zirconium (IV) hexafluoroacetylacetonate
CAS Registry Number:19530-02-0
Formula:Zr(CF3COCHCOCF3)4
EINECS Number:none
Chemical Family:metal fluorobeta-diketonate complexes
Synonym:Zirconium hexafluoro 2,4-pentanedionate

Section 2: Composition and Information on Ingredients
IngredientCAS NumberPercentACGIH (TWA)OSHA (PEL)
Title compound19530-02-0100%5mg/m3 (as Zr)5mg/m3 (as Zr)

Section 3: Hazards Identification
Emergency Overview:Irritating to skin, eyes, and respiratory tract.
Primary Routes of Exposure:Contact with skin and eyes. Inhalation of dust.
Eye Contact:Causes mild to moderate irritation of the eyes.
Skin Contact:Causes slight to mild irritation of the skin.
Inhalation:Dust is irritating to the nose, mucous membranes and respiratory tract.
Ingestion:No information is available on the physiological effects of ingestion.
Acute Health Affects:Irritating to skin, eyes and respiratory tract.
Product contains fluorine which under certain conditions of use, decomposition, or metabolism, may generate
Chronic Health Affects:fluoride ion, causing nausea, vomiting, labored breathing, hypocalcaemia, deterioration of bone and tooth
structure, kidney and liver damage.
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 in
Inhalation:
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, firefighters should be equipped with NIOSH approved positive pressure
Special Fire Fighting Procedures:
self-contained breathing apparatus.
Hazardous Combustion andIf involved in a fire this material may release toxic and corrosive fumes.
Decomposion Products:
Unusual Fire or Explosion Hazards: No unusual fire or explosion hazards.

SECTION 6: Accidental Release Measures
Spill and Leak Procedures:Sweep up the solids and dispose of properly.

SECTION 7: Handling and Storage
Handling and Storage:Store the material 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 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 Respiratory
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:white to off-white xtl.
Molecular Weight:919.47
Melting Point:41-43°
Boiling Point:225°C
Vapor Pressure:no data
Specific Gravity:no data
Odor:not determined
Solubility in Water:insoluble

SECTION 10: Stability and Reactivity
Stability:hygroscopic
Hazardous Polymerization:No hazardous polymerization.
Conditions to Avoid:none
Incompatibility:strong oxidizing agents
Decomposition Products:hydrogen fluoride, organic fumes, carbon monoxide, carbon dioxide and zirconium oxide.

SECTION 11: Toxicological Information
RTECS Data:No information available in the RTECS files.
Carcinogenic Effects:no data
Mutagenic Effects:no data
Tetratogenic Effects:no data

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

生态学数据:

通常对水体是稍微有害的,不要将未稀释或大量产品接触地下水,水道或污水系统,未经政府许可勿将材料排入周围环境。

风险声明 (欧洲) R36/37/38
安全声明 (欧洲) S26

将六氟乙酰丙酮铵(由六氟乙酰丙酮用氨水中和制得)溶于适量的乙醚中,将氯化锆水溶液加到上述乙醚溶液中,搅拌,反应中生成的锆离子螯合物进入乙醚层,分出醚层,用无水硫酸钠干燥后,蒸去乙醚,得到六氟乙酰丙酮锆产品。可用水甲醇(9∶1)混合溶剂重结晶。