4402-83-9 (n-苄基基三氟甲磺酸甲胺,3-(2,6-Dichlorophenyl)-5-methyl-4-isoxazolylcarboxylic Acid Methyl Ester)

快速询单

结构式：

n-苄基基三氟甲磺酸甲胺MOL文件

CAS号：

4402-83-9

中文名称：

n-苄基基三氟甲磺酸甲胺

英文名称：

3-(2,6-Dichlorophenyl)-5-methyl-4-isoxazolylcarboxylic Acid Methyl Ester

分子式：

C₁₂H₉Cl₂NO₃

分子量：

286.110761404037

n-苄基基三氟甲磺酸甲胺(4402-83-9)名称与标识符

名称

中文别名：

3-(2,6-二氯苯基)-5-甲基异噁唑-4-羧酸甲酯;n-苄基基三氟甲磺酸甲胺;

英文别名：

4-Isoxazolecarboxylicacid, 3-(2,6-dichlorophenyl)-5-methyl-, methyl ester;3-(2,6-Dichlorophenyl)-5-methyl-4-isoxazolylcarboxylic Acid Methyl Ester;methyl 3-(2,6-dichlorophenyl)-5-methyl-1,2-oxazole-4-carboxylate;Methyl 3-(2,6-dichlorophenyl)-5-Methyl-4-isoxazolecarboxylate;Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate;3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxylic acid,methyl ester;3-(2,6-Dichlorophenyl)-5-methylisoxazole-4-carboxylic acid methyl ester;3-<2,6-Dichlor-phenyl>-5-methyl-isoxazol-4-carbonsaeure-methylester;CS-0320036;HMS566M12;MFCD00115005;4402-83-9;AKOS005084270;DTXSID50347250;SCHEMBL11894104;Methyl 3-(2,6-dichlorophenyl)-5-methyl-4-isoxazolecarboxylate #;CHEMBL215713;Maybridge1_008900;FT-0628476;SY229467;3-(2,6-Dichlorophenyl)-5-methyl-4-isoxazolylcarboxylic-13C4AcidMethylEster;2C-008;DB-087143;

标识符

MDL：

MFCD00115005

InChIKey：

YPCASVCAZYPZOI-UHFFFAOYSA-N

Inchi：

1S/C12H9Cl2NO3/c1-6-9(12(16)17-2)11(15-18-6)10-7(13)4-3-5-8(10)14/h3-5H,1-2H3

SMILES：

ClC1C=CC=C(C=1C1C(C(=O)OC)=C(C)ON=1)Cl

n-苄基基三氟甲磺酸甲胺(4402-83-9)物化性质

实验特性

LogP : 3.74340
PSA : 52.33000
折射率 : 1.561
沸点 : 382.4 °C at 760 mmHg
熔点 : 115 °C
闪点 : 185.1 °C
密度 : 1.37

计算特性

精确分子量 : 284.99600
氢键供体数量 : 0
氢键受体数量 : 2
可旋转化学键数量 : 3
同位素质量 : 284.995949
重原子数量 : 18
复杂度 : 306
同位素原子数量 : 0
确定原子立构中心数量 : 0
不确定原子立构中心数量 : 0
确定化学键立构中心数量 : 0
不确定化学键立构中心数量 : 0
共价键单元数量 : 1
疏水参数计算参考值（XlogP） : 3.5
拓扑分子极性表面积 : 52.3

n-苄基基三氟甲磺酸甲胺(4402-83-9)安全信息

安全术语： S26;S37/39
安全说明： S26
风险术语： R36/37/38
危险品标志： Xi

n-苄基基三氟甲磺酸甲胺(4402-83-9)海关数据

海关编码：

2934999090

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

Summary：

2934999090. other heterocyclic compounds. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

n-苄基基三氟甲磺酸甲胺(4402-83-9)推荐厂家更多厂家(3)

公司名称	手机号/电话	联系人	QQ	询单
上海瀚思化工有限公司	18939883912 021-34536277	顾经理	3003949364	询单
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上海麦克林生化科技股份有限公司	15221275939 021-50706066	沈经理	269348414	询单

n-苄基基三氟甲磺酸甲胺(4402-83-9)上下游

3-(2,6-二氯苯基)-5-甲基-4-异恶唑甲酸乙酰乙酸甲酯 2,6-二氯苯甲醛肟 2,6-二氯-N-羟基-氯代苯甲醛肟 2,6-二氯苯甲醛

n-苄基基三氟甲磺酸甲胺(4402-83-9) MSDS

基础信息

Name:	Methyl 3-(2 6-dichlorophenyl)-5-methylisoxazole-4-carboxylate 97% Material Safety Data Sheet
Synonym:
CAS:	4402-83-9

Section 1 - Chemical Product ? MSDS Name:Methyl 3-(2 6-dichlorophenyl)-5-methylisoxazole-4-carboxylate 97% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
4402-83-9	Methyl 3-(2,6-dichlorophenyl)-5-methyl	97%	unlisted

Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes 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. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
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:
Facilities storing or utilizing this material should be equipped with an eyewash facility and a safety shower. Use adequate ventilation to keep airborne concentrations low.
Exposure Limits CAS# 4402-83-9: 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: white crystalline solid
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 115 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: C12H9Cl2NO3
Molecular Weight: 286

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Reducing agents, oxidizing agents, bases.
Hazardous Decomposition Products:
Hydrogen chloride, chlorine, hydrogen cyanide, nitrogen oxides, carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 4402-83-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Methyl 3-(2,6-dichlorophenyl)-5-methylisoxazole-4-carboxylate - 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: XI
Risk Phrases:
R 36/37/38 Irritating to eyes, respiratory system
and skin.
Safety Phrases:
S 26 In case of contact with eyes, rinse immediately
with plenty of water and seek medical advice.
S 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 4402-83-9: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 4402-83-9 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 4402-83-9 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A