54629-13-9 (2-(4-氟苯氧基)烟酸,2-(4-Fluorophenoxy)nicotinic acid)

快速询单

结构式：

2-(4-氟苯氧基)烟酸MOL文件

CAS号：

54629-13-9

中文名称：

2-(4-氟苯氧基)烟酸

英文名称：

2-(4-Fluorophenoxy)nicotinic acid

分子式：

C₁₂H₈FNO₃

分子量：

233.195226669312

2-(4-氟苯氧基)烟酸(54629-13-9)名称与标识符

名称

中文别名：

2-(4-氟苯氧基)烟酸;2-(4-氟苯氧基)吡啶-3-甲酸;2-(4-氟苯)烟酸;

英文别名：

2-(4-Fluorophenoxy)nicotinic acid;2-(4-fluorophenoxy)pyridine-3-carboxylic acid;AC1LCQWJ;AC1Q73PC;ACMC-1AKQK;Maybridge1_000048;MixCom1_000092;PubChem16292;SBB028563;AKOS000138092;SR-01000524635-1;CS-0319842;DTXSID50345514;2-(4-Fluoro-phenoxy)-nicotinic acid;MFCD00833409;2-[4-fluoro-phenoxy]-nicotinic acid;Oprea1_612919;54629-13-9;SR-01000524635;AS-61591;SCHEMBL2779361;2-(4-fluorophenoxy)-3-pyridinecarboxylic acid;A830274;FT-0608643;2-(4-Fluorophenoxy)pyridine-3-carboxylic acid, 3-Carboxy-2-(4-fluorophenoxy)pyridine, 1-[(3-Carboxypyridin-2-yl)oxy]-4-fluorobenzene;AG-205/12192085;2-(4-FLUOROPHENOXY)NICOTINICACID;

标识符

MDL：

MFCD00833409

InChIKey：

SDZUYDOXBXHDCE-UHFFFAOYSA-N

Inchi：

1S/C12H8FNO3/c13-8-3-5-9(6-4-8)17-11-10(12(15)16)2-1-7-14-11/h1-7H,(H,15,16)

SMILES：

FC1C=CC(=CC=1)OC1C(C(=O)O)=CC=CN=1

2-(4-氟苯氧基)烟酸(54629-13-9)物化性质

实验特性

LogP : 2.71120
PSA : 59.42000
沸点 : 365.2±37.0 °C at 760 mmHg
熔点 : 187 °C
蒸气压 : 0.0±0.9 mmHg at 25°C
闪点 : 174.7±26.5 °C
颜色与性状 : No data available
密度 : 1.4±0.1 g/cm3

计算特性

精确分子量 : 233.04900
氢键供体数量 : 1
氢键受体数量 : 4
可旋转化学键数量 : 3
同位素质量 : 233.049
重原子数量 : 17
复杂度 : 267
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） : 2.3
拓扑分子极性表面积 : 59.4A^2

2-(4-氟苯氧基)烟酸(54629-13-9)安全信息

安全术语： S24/25
安全说明： S24/25
风险术语： R36/37/38
危险品标志： Xi
危害声明：Irritant
警示性声明：P264处理后彻底清洗+P280戴防护手套/穿防护服/戴防护眼罩/戴防护面具+P305如果进入眼睛+P351用水小心冲洗几分钟+P338取出隐形眼镜（如果有）并且易于操作,继续冲洗+P337如果眼睛刺激持续+P313获得医疗建议/护理
储存条件： storage at -4℃ (1-2weeks), longer storage period at -20℃ (1-2years)
危险类别码： 36/37/38
信号词： warning

2-(4-氟苯氧基)烟酸(54629-13-9)海关数据

海关编码：

2933399090

海关数据：

中国海关编码：

2933399090

概述：

2933399090. 其他结构含非稠合吡啶环的化合物. 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, 乌洛托品请注明外观, 6－己内酰胺请注明外观, 签约日期

Summary：

2933399090. other compounds containing an unfused pyridine ring (whether or not hydrogenated) in the structure. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:20.0%

2-(4-氟苯氧基)烟酸(54629-13-9)推荐厂家更多厂家(2)

公司名称	手机号/电话	联系人	QQ	微信	询单
江苏艾康生物医药研发有限公司	18795912720 025-66061636	杨情情	3004779232		询单
上海麦克林生化科技股份有限公司	15221275939 021-50706066	沈经理	269348414		询单

2-(4-氟苯氧基)烟酸(54629-13-9) MSDS

基础信息

Name:	2-(4-Fluorophenoxy)nicotinic acid 97% Material Safety Data Sheet
Synonym:	2-(4-Fluorophenoxy)pyridine-3-carboxylic aci
CAS:	54629-13-9

Section 1 - Chemical Product ? MSDS Name:2-(4-Fluorophenoxy)nicotinic acid 97% Material Safety Data Sheet
Synonym:2-(4-Fluorophenoxy)pyridine-3-carboxylic aci

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
54629-13-9	2-(4-Fluorophenoxy)nicotinic acid	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# 54629-13-9: 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: off-white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 187 - 189 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: C12H8FNO3
Molecular Weight: 233

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

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 54629-13-9 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-(4-Fluorophenoxy)nicotinic acid - 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# 54629-13-9: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 54629-13-9 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 54629-13-9 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A