22446-12-4 (4-甲氧基苯氧基乙腈,2-(4-Methoxyphenoxy)acetonitrile)

CAS号:
22446-12-4
中文名称:
4-甲氧基苯氧基乙腈
英文名称:
2-(4-Methoxyphenoxy)acetonitrile
分子式:
C9H9NO2
分子量:
163.173262357712

4-甲氧基苯氧基乙腈(22446-12-4)名称与标识符

名称

中文别名:
4-甲氧基苯氧基乙腈;4-甲氧基苯氧乙腈;(4-甲氧基苯氧基)乙腈;2-甲基-2-(5-硝基-2-吡啶基)丙腈;
英文别名:
4-Methoxyphenoxyacetonitrile;2-(4-Methoxyphenoxy)acetonitrile;2-(4-Methoxyphenoxy)-acetonitrile;(p-Methoxyphenoxy)acetonitrile;(4-Methoxyphenoxy)acetonitrile;SNADCCRKYFVIEJ-UHFFFAOYSA-N;Acetonitrile, (4-methoxyphenoxy)-;2-(4-methoxyphenoxy)ethanenitrile;p-methoxy-phenoxyacetonitrile;(4-Methoxyphenoxy)acetonitrile #;SBB055362;7675AD;Acetonitrile, 2-(4-methoxyphenoxy)-;TRA0078402;22446-12-4;FT-0618947;MFCD00017528;SY011003;TS-02171;A919954;SCHEMBL481286;FT-0618948;DTXSID50342184;AKOS000191851;EN300-52056;Acetonitrile,2-(4-methoxyphenoxy)-;Z53792243;CS-0216596;DB-045925;

标识符

MDL:
MFCD00017528
InChIKey:
SNADCCRKYFVIEJ-UHFFFAOYSA-N
Inchi:
1S/C9H9NO2/c1-11-8-2-4-9(5-3-8)12-7-6-10/h2-5H,7H2,1H3
SMILES:
O(CC#N)C1C=CC(=CC=1)OC
BRN:
2444937

4-甲氧基苯氧基乙腈(22446-12-4)物化性质

实验特性

  • LogP : 1.59758
  • PSA : 42.25000
  • 折射率 : 1.5270
  • 沸点 : 294 ºC
  • 闪点 : 122 ºC
  • 颜色与性状 : 未确定2. 密度(g/mL,25/4℃)
  • 密度 : 1.107

计算特性

  • 精确分子量 : 163.06300
  • 氢键供体数量 : 0
  • 氢键受体数量 : 3
  • 可旋转化学键数量 : 3
  • 同位素质量 : 163.063
  • 重原子数量 : 12
  • 复杂度 : 165
  • 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) : 1.7
  • 互变异构体数量 : 无
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 42.2

4-甲氧基苯氧基乙腈(22446-12-4)安全信息

4-甲氧基苯氧基乙腈(22446-12-4)海关数据

海关编码:
2926909090
海关数据:

中国海关编码:

2926909090

概述:

2926909090 其他腈基化合物. 增值税率:17.0% 退税率:9.0% 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

Summary:

HS:2926909090 other nitrile-function compounds VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

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4-甲氧基苯氧基乙腈(22446-12-4)相关文献

4-甲氧基苯氧基乙腈(22446-12-4) MSDS

基础信息

Name:2-(4-Methoxyphenoxy)acetonitrile 97% Material Safety Data Sheet
Synonym:
CAS:22446-12-4
Section 1 - Chemical Product ? MSDS Name:2-(4-Methoxyphenoxy)acetonitrile 97% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
22446-12-42-(4-Methoxyphenoxy)acetonitrile97%unlisted
Hazard Symbols: XN
Risk Phrases: 20/21/22 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Harmful by inhalation, in contact with skin and if swallowed.
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. Harmful if absorbed through the skin.
Ingestion:
Harmful if swallowed. May cause irritation of the digestive tract.
Inhalation:
Harmful if inhaled. Causes respiratory tract irritation.
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:

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:
Absorb spill with inert material (e.g. vermiculite, sand or earth), then place in suitable 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# 22446-12-4: 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: Liquid
Color: colorless
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: 101 deg C @0.01mmHg
Freezing/Melting Point: Not available.
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: C9H9NO2
Molecular Weight: 163

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

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 22446-12-4 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
2-(4-Methoxyphenoxy)acetonitrile - 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
Shipping Name: NITRILES, LIQUID, TOXIC, N.O.S.*
Hazard Class: 6.1
UN Number: 3276
Packing Group: III
IMO
Shipping Name: NITRILES, TOXIC, N.O.S.
Hazard Class: 6.1
UN Number: 3276
Packing Group: III
RID/ADR
Shipping Name: NITRILES, TOXIC, N.O.S.
Hazard Class: 6.1
UN Number: 3276
Packing group: III

Section 15 - REGULATORY INFORMATION
?
European/International Regulations
European Labeling in Accordance with EC Directives
Hazard Symbols: XN
Risk Phrases:
R 20/21/22 Harmful by inhalation, in contact with
skin and if swallowed.
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 36/37/39 Wear suitable protective clothing, gloves
and eye/face protection.
WGK (Water Danger/Protection)
CAS# 22446-12-4: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 22446-12-4 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 22446-12-4 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A