5-(4-氟苯基)异恶唑

  • 基本信息
  • 物化性质
  • 安全信息
  • 毒理性
  • MSDS
  • 海关数据
  • 结构与计算化学
  • 上游产品

5-(4-氟苯基)异恶唑 基本信息

中文名称:
5-(4-氟苯基)异恶唑 
中文别名:
5-(4-氟苯基)异恶唑;
5-(4-氟苯基)异噁唑 
英文名称:
5-(4-fluorophenyl)isoxazole
英文别名:
5-(4-Fluorophenyl)isoxazole;
5-(4-fluorophenyl)-1,2-oxazole 
CAS No.:
138716-37-7
分 子 式:
C9H6FNO
分 子 量:
163.15
精确分子量:
163.04300
PSA:
26.03000
MDL:
MFCD02183544
InChI:
The Key: JZCBQTRPILCIBC-UHFFFAOYSA-N
危险品标志:

IrritantXi
风险术语:
 Xi:Irritant;
分子结构式:
SDS:
查看

5-(4-氟苯基)异恶唑 物化性质

密度:
1.209g/cm3
熔点:
53-56ºC
沸点:
275.8ºC at 760 mmHg
闪点:
120.6ºC
折射率:
1.523
蒸汽压:
0.00838mmHg 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,未有已知危险反应

避免氧化物
其它信息:

1.        性状:奶油色晶体状粉末

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):53-56

5.         沸点(ºC,常压):未确定

6.         沸点(ºC,KPa):未确定

7.         折射率:未确定

8.         闪点(ºC):未确定

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(Pa,20ºC):未确定

12.      饱和蒸气压(KPa,20ºC):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

5-(4-氟苯基)异恶唑 安全信息

海关代码:
2934999090
危险标志:
Xi:Irritant;

5-(4-氟苯基)异恶唑 毒理性

生态数据:

通常对水是稍微有危害的,若无政府许可,勿将材料排入周围环境。

5-(4-氟苯基)异恶唑 MSDS

  Material Safety Data Sheet

Section 1. Identification of the substance
    Product Name:      5-(4-Fluorophenyl)isoxazole    
    Synonyms:

Section 2. Hazards identification
    Harmful by inhalation, in contact with skin, and if swallowed.

Section 3. Composition/information on ingredients.
    Ingredient name:        5-(4-Fluorophenyl)isoxazole    
    CAS number:        138716-37-7    

Section 4. First aid measures
    Skin contact:        Immediately wash skin with copious amounts of water for at least 15 minutes while removing    
    contaminated clothing and shoes. If irritation persists, seek medical attention.
    Eye contact:        Immediately wash skin with copious amounts of water for at least 15 minutes. Assure adequate    
    flushing of the eyes by separating the eyelids with fingers. If irritation persists, seek medical
    attention.
    Inhalation:        Remove to fresh air. In severe cases or if symptoms persist, seek medical attention.    
    Ingestion:        Wash out mouth with copious amounts of water for at least 15 minutes. Seek medical attention.    

Section 5. Fire fighting measures
    In the event of a fire involving this material, alone or in combination with other materials, use dry
    powder or carbon dioxide extinguishers. Protective clothing and self-contained breathing apparatus
    should be worn.

Section 6. Accidental release measures
    Personal precautions: Wear suitable personal protective equipment which performs satisfactorily and meets local/state/national
    standards.
    Respiratory precaution:        Wear approved mask/respirator    
    Hand precaution:        Wear suitable gloves/gauntlets    
    Skin protection:        Wear suitable protective clothing    
    Eye protection:        Wear suitable eye protection    
    Methods for cleaning up: Mix with sand or similar inert absorbent material, sweep up and keep in a tightly closed container
    for disposal. See section 12.
    Environmental precautions: Do not allow material to enter drains or water courses.

Section 7. Handling and storage
    Handling:        This product should be handled only by, or under the close supervision of, those properly qualified    
    in the handling and use of potentially hazardous chemicals, who should take into account the fire,
    health and chemical hazard data given on this sheet.
    Store in closed vessels.
    Storage:

Section 8. Exposure Controls / Personal protection
    Engineering Controls: Use only in a chemical fume hood.
    Personal protective equipment: Wear laboratory clothing, chemical-resistant gloves and safety goggles.
    General hydiene measures: Wash thoroughly after handling. Wash contaminated clothing before reuse.

Section 9. Physical and chemical properties
    Appearance:        Not specified    
    Boiling point:        No data    
    No data
    Melting point:
    Flash point:        No data    
    Density:        No data    
    Molecular formula:        C9H6FNO    
    Molecular weight:        163.1    

Section 10. Stability and reactivity
    Conditions to avoid: Heat, flames and sparks.
    Materials to avoid: Oxidizing agents.
    Possible hazardous combustion products: Carbon monoxide, nitrogen oxides, hydrogen fluoride.

Section 11. Toxicological information
    No data.

Section 12. Ecological information
    No data.

Section 13. Disposal consideration
    Arrange disposal as special waste, by licensed disposal company, in consultation with local waste
    disposal authority, in accordance with national and regional regulations.

Section 14. Transportation information
    Non-harzardous for air and ground transportation.

Section 15. Regulatory information
    No chemicals in this material are subject to the reporting requirements of SARA Title III, Section
    302, or have known CAS numbers that exceed the threshold reporting levels established by SARA
    Title III, Section 313.


SECTION 16 - ADDITIONAL INFORMATION
N/A

5-(4-氟苯基)异恶唑 海关数据

中国海关编码:2934999090

概述:
2934999090. 其他杂环化合物. 增值税率:17.0%. 退税率:13.0%. 监管条件:无. 最惠国关税:6.5%. 普通关税:20.0%
申报要素:
品名, 成分含量, 用途
摘要/Summary:
2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

5-(4-氟苯基)异恶唑 分子结构与计算化学数据

分子结构数据

1、摩尔折射率:41.22

2、摩尔体积(cm3/mol):134.9

3、等张比容(90.2K):335.8

4、表面张力(dyne/cm):38.3

5、介电常数:无可用的

6、极化率(10-24cm3):16.34

7、单一同位素质量:163.043342 Da

8、标称质量:163 Da

9、平均质量:163.1484 Da

计算化学数据

1.疏水参数计算参考值(XlogP):2.1

2.氢键供体数量:0

3.氢键受体数量:3

4.可旋转化学键数量:1

5.互变异构体数量:无

6.拓扑分子极性表面积26

7.重原子数量:12

8.表面电荷:0

9.复杂度:146

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:1

5-(4-氟苯基)异恶唑 上游产品

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淄博航宇生物科技发展有限公司

产品介绍:
产品名称:5-(4-氟苯基)异恶唑 Cas号:138716-37-7 纯度:99% 包装信息:100kg 价格:洽谈
联系方式:
联系人:张经理 电话:15666366704 手机:15666366704

山东西亚化学有限公司

产品介绍:
产品名称:5-(4-氟苯基)异恶唑 Cas号:138716-37-7 纯度:99% 包装信息:1g 价格:201.0元
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