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399-96-2

399-96-2结构式
399-96-2结构式

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中文名 4-氨基-2-氟苯酚
英文名 4-Amino-2-fluorophenol
中文别名 3-氟-4-羟基苯胺
2-氟-4-氨基苯酚
英文别名 4-Amino-2-fluorophenol
Phenol, 4-amino-2-fluoro-
3-Fluoro-4-hydroxyaniline
ZR DQ CF
MFCD00671760
密度 1.3±0.1 g/cm3
沸点 263.3±25.0 °C at 760 mmHg
熔点 170-172°C
分子式 C6H6FNO
分子量 127.116
闪点 113.1±23.2 °C
精确质量 127.043343
PSA 46.25000
LogP 0.34
蒸汽压 0.0±0.6 mmHg at 25°C
折射率 1.602
储存条件 室温
分子结构

1、 摩尔折射率:32.36

2、 摩尔体积(m3/mol):94.3

3、 等张比容(90.2K):255.2

4、 表面张力(dyne/cm):53.5

5、 极化率(10 -24cm 3):12.83

计算化学

1.疏水参数计算参考值(XlogP):1

2.氢键供体数量:2

3.氢键受体数量:3

4.可旋转化学键数量:0

5.互变异构体数量:7

6.拓扑分子极性表面积46.2

7.重原子数量:9

8.表面电荷:0

9.复杂度:99.1

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

更多

一、物性数据

性状:不可用

密度(g/mL,25/4℃):不可用

相对蒸汽密度(g/mL,空气=1):不可用

熔点(ºC):170-172

沸点(ºC,常压):不可用

沸点(ºC,5.2kPa):不可用

折射率:不可用

闪点(ºC):不可用

比旋光度(º):不可用

自燃点或引燃温度(ºC):不可用

蒸气压(kPa,25ºC):不可用

饱和蒸气压(kPa,60ºC):不可用

燃烧热(KJ/mol):不可用

临界温度(ºC):不可用

临界压力(KPa):不可用

油水(辛醇/水)分配系数的对数值:不可用

爆炸上限(%,V/V):不可用

爆炸下限(%,V/V):不可用

溶解性:不可用

4-Amino-2-fluorophenol Revision number: 1
SAFETY DATA SHEET

Section1. BASE INFORMATION
Product name:4-Amino-2-fluorophenol

Revision number:1

Section2. HAZARDS IDENTIFICATION
Classification of the GHS
PHYSICAL HAZARDSNot classified
HEALTH HAZARDS
Category 4
Acute toxicity (Oral)
Skin corrosion/irritationCategory 2
Category 2A
Serious eye damage/eye irritation
ENVIRONMENTAL HAZARDSNot classified
GHS label elements
Pictograms or hazard symbols
Signal wordWarning
Hazard statementHarmful if swallowed
Causes skin irritation
Causes serious eye irritation
Precautionary statements
[Prevention]Do not eat, drink or smoke when using this product.
Wash hands thoroughly after handling.
Wear protective gloves/eye protection/face protection.
IF SWALLOWED: Call a POISON CENTER or doctor/physician if you feel unwell.
[Response]
Rinse mouth.
IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses,
if present and easy to do. Continue rinsing.
If eye irritation persists: Get medical advice/attention.
IF ON SKIN: Gently wash with plenty of soap and water.
If skin irritation occurs: Get medical advice/attention.
Take off contaminated clothing and wash before reuse.
[Disposal]Dispose of contents/container through a waste management company authorized by
the local government

Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Substance/mixture:Substance
Component(s):4-Amino-2-fluorophenol
Percent:>98.0%(GC)(T)
399-96-2
CAS Number:
Synonyms:3-Fluoro-4-hydroxyaniline
4-Amino-2-fluorophenol

Section3. COMPOSITION/INFORMATION ON INGREDIENTS
Chemical Formula:C6H6FNO

Section4. FIRST AID MEASURES
Inhalation:Remove victim to fresh air and keep at rest in a position comfortable for breathing.
Get medical advice/attention if you feel unwell.
Skin contact:Remove/Take off immediately all contaminated clothing. Gently wash with plenty of
soap and water. If skin irritation or rash occurs: Get medical advice/attention.
Eye contact:Rinse cautiously with water for several minutes. Remove contact lenses, if present
and easy to do. Continue rinsing. If eye irritation persists: Get medical
advice/attention.
Call a POISON CENTER or doctor/physician if you feel unwell. Rinse mouth.
Ingestion:
Protection of first-aiders:A rescuer should wear personal protective equipment, such as rubber gloves and air-
tight goggles.

Section5. FIRE-FIGHTING MEASURES
Dry chemical, foam, water spray, carbon dioxide.
Suitable extinguishing
media:
Take care as it may decompose upon combustion or in high temperatures to
Specific hazards:
generate poisonous fume.
Fire-extinguishing work is done from the windward and the suitable fire-extinguishing
Specific methods:
method according to the surrounding situation is used. Uninvolved persons should
evacuate to a safe place. In case of fire in the surroundings: Remove movable
containers if safe to do so.
Special protectiveWhen extinguishing fire, be sure to wear personal protective equipment.
equipment for firefighters:

Section6. ACCIDENTAL RELEASE MEASURES
Personal precautions,Use personal protective equipment. Keep people away from and upwind of spill/leak.
protective equipment and Entry to non-involved personnel should be controlled around the leakage area by
emergency procedures: roping off, etc.
Environmental precautions: Prevent product from entering drains.
Methods and materials for Sweep dust to collect it into an airtight container, taking care not to disperse it.
containment and cleaning Adhered or collected material should be promptly disposed of, in accordance with
up: appropriate laws and regulations.

Section7. HANDLING AND STORAGE
Handling
Technical measures:Handling is performed in a well ventilated place. Wear suitable protective equipment.
Prevent dispersion of dust. Wash hands and face thoroughly after handling.
Use a local exhaust if dust or aerosol will be generated.
Avoid contact with skin, eyes and clothing.
Advice on safe handling:
Storage
Keep container tightly closed. Store in a cool and dark place.
Storage conditions:
Store under inert gas.
Store away from incompatible materials such as oxidizing agents.
Packaging material:Law is followed.

Section8. EXPOSURE CONTROLS / PERSONAL PROTECTION
Engineering controls:Install a closed system or local exhaust as possible so that workers should not be
exposed directly. Also install safety shower and eye bath.
Personal protective equipment
Respiratory protection: Dust respirator. Follow local and national regulations.
Hand protection:Protective gloves.
Eye protection:Safety glasses. A face-shield, if the situation requires.
Skin and body protection: Protective clothing. Protective boots, if the situation requires.
4-Amino-2-fluorophenol

Section9. PHYSICAL AND CHEMICAL PROPERTIES
Physical state (20°C):Solid
Form:crystal - powder
Pale yellow - Greyish yellow red
Color:
Odor:No data available
pH: No data available
Melting point/freezing point:164°C (dec.)
No data available
Boiling Point/Range:
Flash Point:No data available
Explosive limits
Lower:No data available
Upper:No data available
Density:No data available
Soluble in : Methanol
Solubility:

Section10. STABILITY AND REACTIVITY
Stability:Stable under proper conditions.
Reactivity:No special reactivity has been reported.
Conditions to avoid:Air-sensitive
Incompartible materials: oxidizing agents
Hazardous Decomposition Carbon monoxide, Carbon dioxide, Nitrogen oxides (NOx), Hydrogen fluoride
Products:

Section11. TOXICOLOGICAL INFORMATION
No data available
Acute Toxicity:
Skin corrosion/irritation: No data available
No data available
Serious eye
damage/irritation:
Germ cell mutagenicity: No data available
Carcinogenicity:
IARC =No data available
NTP =No data available
No data available
Reproductive toxicity:

Section12. ECOLOGICAL INFORMATION
Ecotoxicity:
No data available
Fish:
Crustacea:No data available
Algae:No data available
Persistence / degradability: No data available
BioaccumulativeNo data available
potential(BCF):
Mobillity in soil
log Pow:No data available
No data available
Soil adsorption (Koc):
Henry's LawNo data available
constant(PaM3/mol):

Section13. DISPOSAL CONSIDERATIONS
Recycle to process, if possible. Consult your local regional authorities. You may be able to dissolve or mix material
with a combustible solvent and burn in a chemical incinerator equipped with an afterburner and scrubber system.
Observe all federal, state and local regulations when disposing of the substance.

Section14. TRANSPORT INFORMATION
Hazards Class:Does not correspond to the classification standard of the United Nations
Not Listed
UN-No:
4-Amino-2-fluorophenol

Section15. REGULATORY INFORMATION
Safe management ordinance of dangerous chemical product (State Council announces on January 26,
2002): Safe use and production, the storage of a dangerous chemical, transport, loading and unloading were
prescribed.


SECTION 16 - ADDITIONAL INFORMATION
N/A

毒理学数据:

二、毒理学数据:

急性毒性:不可用。

生态学数据:

三、生态学数据:

1、其它有害作用:该物质对环境可能有危害,对水体应给予特别注意。

危害码 (欧洲) Xi: Irritant;
风险声明 (欧洲) R20/21/22
安全声明 (欧洲) S26-S36/37/39
海关编码 2907111000

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399-96-2

文献:Bristol-Myers Squibb Company Patent: US2007/78140 A1, 2007 ; Location in patent: Page/Page column 25-26 ; US 20070078140 A1

~%

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文献:Ishihara Sangyo Kaisha Ltd. Patent: US4861799 A1, 1989 ;

~%

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399-96-2

文献:Aymes, Daniel J.; Paris, Michel R. Bulletin de la Societe Chimique de France, 1980 , vol. 2, # 3-4 p. 175 - 178

~%

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399-96-2

文献:le Guyader,M. Bulletin de la Societe Chimique de France, 1966 , p. 1848 - 1858

~49%

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399-96-2

文献:Venugopala, K. Narayanaswamy; Prasanna, Renuka T.; Odhav, Bharti Asian Journal of Chemistry, 2013 , vol. 25, # 15 p. 8685 - 8689

~%

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399-96-2

文献:Berg; Newbery Journal of the Chemical Society, 1949 , p. 642,645
海关编码 2922299090
中文概述 2922299090. 其他氨基(萘酚、酚)及醚、酯〔包括它们的盐, 但含有一种以上含氧基的除外〕. 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:30.0%
申报要素 品名, 成分含量, 用途, 乙醇胺及其盐应报明色度, 乙醇胺及其盐应报明包装
Summary 2922299090. other amino-naphthols and other amino-phenols, other than those containing more than one kind of oxygen function, their ethers and esters; salts thereof. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%