4-Isoxazolecarboxamide,3-(2-chloro-6-fluorophenyl)-5-methyl-
- 中文别名:3-(2-氯-6-氟苯基)-5-甲基异恶唑-4-甲酰胺
- 中文释义:3-(2-氯-6-氟苯基)-5-甲基异恶唑-4-甲酰胺
- 英文别名:3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carboxamide;
3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxamide;
3-(2-chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carboxylic acid amide;
HMS558J04;
3-<2-Fluor-6-chlor-phenyl>-5-methyl-isoxazol-4-carbonsaeure-amid
- CAS No.:4415-11-6
- 分子式:C11H8ClFN2O2
- 分子量:254.45
- 精确分子量:254.02600
- PSA:69.12000
- InChI:The Key: PPKCMGUTHICRLU-UHFFFAOYSA-N
- 分子结构式:
物化性质
- 密度:
- 1.4g/cm3
- 熔点:
- 127-129ºC
- 沸点:
- 361.6ºC at 760mmHg
- 闪点:
- 172.5ºC
- 折射率:
- 1.321
- 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,灰白色固体
- 其它信息:
1. 性状:灰白色固体
2. 密度(g/mL):不确定
3. 相对蒸汽密度(g/mL,空气=1):不确定
4. 熔点(ºC):127-129
5. 沸点(ºC,7.99kpa):不确定
6. 沸点(ºC,17mmHg):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. 蒸汽压(20ºC):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
安全信息
- 密度:
- 1.4g/cm3
- 熔点:
- 127-129ºC
- 沸点:
- 361.6ºC at 760mmHg
- 闪点:
- 172.5ºC
- 折射率:
- 1.321
- 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,灰白色固体
- 其它信息:
1. 性状:灰白色固体
2. 密度(g/mL):不确定
3. 相对蒸汽密度(g/mL,空气=1):不确定
4. 熔点(ºC):127-129
5. 沸点(ºC,7.99kpa):不确定
6. 沸点(ºC,17mmHg):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. 蒸汽压(20ºC):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
毒理性
- 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
MSDS
Name: | 3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxamide 97% Material Safety Data Sheet |
Synonym: | |
CAS: | 4415-11-6 |
Section 1 - Chemical Product MSDS Name:3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxamide 97% Material Safety Data Sheet
Synonym:
Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS# | Chemical Name | content | EINECS# |
4415-11-6 | 3-(2-Chloro-6-fluorophenyl)-5-methylis | 97% | unlisted |
Hazard Symbols: None Listed.
Risk Phrases: None Listed.
Section 3 - HAZARDS IDENTIFICATION
EMERGENCY OVERVIEW
Not available.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
May cause respiratory tract irritation. May be harmful if inhaled.
Chronic:
Not available.
Section 4 - FIRST AID MEASURES
Eyes: Flush eyes with plenty of water for at least 15 minutes, occasionally lifting the upper and lower eyelids. Get medical aid.
Skin:
Get medical aid. Flush skin with plenty of water for at least 15 minutes while removing contaminated clothing and shoes.
Ingestion:
Get medical aid. Wash mouth out with water.
Inhalation:
Remove from exposure and move to fresh air immediately.
Notes to Physician:
Treat symptomatically and supportively.
Section 5 - FIRE FIGHTING MEASURES
General Information:
As in any fire, wear a self-contained breathing apparatus in pressure-demand, MSHA/NIOSH (approved or equivalent), and full protective gear.
Extinguishing Media:
Use water spray, dry chemical, carbon dioxide, or chemical foam.
Section 6 - ACCIDENTAL RELEASE MEASURES
General Information: Use proper personal protective equipment as indicated in Section 8.
Spills/Leaks:
Vacuum or sweep up material and place into a suitable disposal container.
Section 7 - HANDLING and STORAGE
Handling:
Avoid breathing dust, vapor, mist, or gas. Avoid contact with skin and eyes.
Storage:
Store in a cool, dry place. Store in a tightly closed container.
Section 8 - EXPOSURE CONTROLS, PERSONAL PROTECTION
Engineering Controls:
Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 4415-11-6: Personal Protective Equipment Eyes: Not available.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
Follow the OSHA respirator regulations found in 29 CFR 1910.134 or European Standard EN 149. Use a NIOSH/MSHA or European Standard EN 149 approved respirator if exposure limits are exceeded or if irritation or other symptoms are experienced.
Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
Physical State: Solid
Color: off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 127 - 129 deg C
Autoignition Temperature: Not available.
Flash Point: Not available.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C11H8ClFN2O2
Molecular Weight: 255
Section 10 - STABILITY AND REACTIVITY
Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Oxidizing agents, reducing agents.
Hazardous Decomposition Products:
Hydrogen chloride, chlorine, nitrogen oxides, carbon monoxide, carbon dioxide, fluorine, hydrogen fluoride gas.
Hazardous Polymerization: Has not been reported
Section 11 - TOXICOLOGICAL INFORMATION
RTECS#:
CAS# 4415-11-6 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carboxamide - Not listed by ACGIH, IARC, or NTP.
Section 12 - ECOLOGICAL INFORMATION
Section 13 - DISPOSAL CONSIDERATIONS
Dispose of in a manner consistent with federal, state, and local regulations.
Section 14 - TRANSPORT INFORMATION
IATA
No information available.
IMO
No information available.
RID/ADR
No information available.
Section 15 - REGULATORY INFORMATION
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 4415-11-6: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 4415-11-6 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 4415-11-6 is not listed on the TSCA inventory.
It is for research and development use only.
SECTION 16 - ADDITIONAL INFORMATION
N/A
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%
分子结构与计算化学数据
分子结构数据
1、 摩尔折射率:59.87
2、 摩尔体积(m3/mol):181.8
3、 等张比容(90.2K):483.8
4、 表面张力(dyne/cm):50.0
5、 极化率(10-24cm3):23.73