175137-08-3 (3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯,Methyl 3-amino-5-(4-fluorophenyl)thiophene-2-carboxylate)

快速询单

结构式：

3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯MOL文件

CAS号：

175137-08-3

中文名称：

3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯

英文名称：

Methyl 3-amino-5-(4-fluorophenyl)thiophene-2-carboxylate

分子式：

C₁₂H₁₀FNO₂S

分子量：

251.276705265045

3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯(175137-08-3)名称与标识符

名称

中文别名：

3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯;3-氨基-5-(4-氟苯)噻吩-2-羧酸甲酯;4-氯-3-三氟甲基苯甲酸;

英文别名：

Methyl 3-amino-5-(4-fluorophenyl)thiophene-2-carboxylate;TIMTEC-BB SBB005529;BUTTPARK 37\18-33;METHYL 3-AMINO-5-(4-FLUOROPHEYL)THIOPHENE-2-CARBOXYLATE;Methyl 3-Amino-5-(4-Fluoropheyl)Thiophen;methyl 3-amino-5-(3-fluorophenyl)thiophene-2-carboxylate;Methyl3-amino-5-(4-fluorophenyl)thiophene-2-carboxylate97%;Methyl 3-amino-5-(4-fluorophenyl)thiophene-2-carboxylate 97%;SCHEMBL1724239;175137-08-3;PS-6680;Cyclododecylideneaceticacidethylester;Methyl 3-amino-5-(4-fluorophenyl)thiophene-2-carboxylate, AldrichCPR;Methyl 3-amino-5-(4-fluorophenyl)-2-thiophenecarboxylate;FT-0628538;Z384975552;2-Thiophenecarboxylic acid, 3-amino-5-(4-fluorophenyl)-, methyl ester;AKOS000352106;EN300-1267365;HMS552I21;BDBM50353368;3-Amino-5-(4-fluoro-phenyl)-thiophene-2-carboxylic acid methyl ester;CS-0206987;MFCD00068133;CHEMBL1831216;Maybridge1_003893;DTXSID90347279;2-Thiophenecarboxylicacid,3-amino-5-(4-fluorophenyl)-,methyl ester;STL220636;3-Amino-5-(4-fluorophenyl)-2-(methoxycarbonyl)thiophene, Methyl 3-amino-5-(4-fluorophenyl)-2-thenoate;DB-044046;

标识符

MDL：

MFCD00068133

InChIKey：

YIBRKYVKVWTHEM-UHFFFAOYSA-N

Inchi：

1S/C12H10FNO2S/c1-16-12(15)11-9(14)6-10(17-11)7-2-4-8(13)5-3-7/h2-6H,14H2,1H3

SMILES：

S1C(C(=O)OC)=C(C=C1C1C=CC(=CC=1)F)N

3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯(175137-08-3)物化性质

实验特性

LogP : 3.50420
PSA : 80.56000
折射率 : 1.608
沸点 : 438.8°Cat760mmHg
熔点 : 153-155°C
闪点 : 219.2°C
颜色与性状 : 茶色粉末
溶解性 : 未确定
敏感性 : Stench
密度 : 1.332

计算特性

精确分子量 : 251.04200
氢键供体数量 : 1
氢键受体数量 : 3
可旋转化学键数量 : 3
同位素质量 : 251.04162790g/mol
重原子数量 : 17
复杂度 : 282
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） : 3.4
互变异构体数量 : 3
表面电荷 : 0
拓扑分子极性表面积 : 80.6Å²

3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯(175137-08-3)安全信息

3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯(175137-08-3)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%

3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯(175137-08-3)推荐厂家更多厂家(11)

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3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯(175137-08-3)上下游

巯基乙酸甲酯对氟苯乙酮 N,N-二甲基甲酰胺

3-氨基-5-(4-氟苯基)噻吩-2-羧酸甲酯(175137-08-3) MSDS

基础信息

Name:	Methyl 3-amino-5-(4-fluorophenyl)thiophene-2-carboxylate 97% Material Safety Data Sheet
Synonym:
CAS:	175137-08-3

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

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
175137-08-3	Methyl 3-amino-5-(4-fluorophenyl)thiop	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# 175137-08-3: 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: 153 - 155 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: C12H10FNO2S
Molecular Weight: 251

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents, acid chlorides.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, oxides of sulfur, carbon dioxide, fluorine, hydrogen fluoride gas.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 175137-08-3 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
Methyl 3-amino-5-(4-fluorophenyl)thiophene-2-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: Not available.
Risk Phrases:
Safety Phrases:
S 24/25 Avoid contact with skin and eyes.
WGK (Water Danger/Protection)
CAS# 175137-08-3: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 175137-08-3 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 175137-08-3 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A