20567-38-8 (4,5-二甲氧基-2-硝基肉桂酸,4,5-Dimethoxy-2-Nitrocinnamic Acid)

CAS号:
20567-38-8
中文名称:
4,5-二甲氧基-2-硝基肉桂酸
英文名称:
4,5-Dimethoxy-2-Nitrocinnamic Acid
分子式:
C11H11NO6
分子量:
253.208143472672

4,5-二甲氧基-2-硝基肉桂酸(20567-38-8)名称与标识符

名称

中文别名:
4,5-二甲氧基-2-硝基肉桂酸;4,5-二甲基-2-硝基肉桂酸;
英文别名:
3-(4,5-Dimethoxy-2-nitrophenyl)acrylic acid;4,5-Dimethoxy-2-nitrocinnamic acid;2-nitro-4,5-dimethoxycinnamic acid;2-Nitro-4,5-dimethoxy-trans-cinnamic acid;3,4-DIMETHOXY-6-NITROCINNAMIC ACID;4,5-Dimethoxy-2-nitrociamic acid;6-nitro-3,4-dimethoxycinnamic acid;6-nitro-3.4-dimethoxy-trans-cinnamic acid;6-Nitro-3.4-dimethoxy-trans-zimtsaeure;RARECHEM BK HW 0176;3-(4,5-Dimethoxy-2-nitrophenyl)-2-propenoic acid;BZIRMMAJZSOLEW-ONEGZZNKSA-N;CS-0312877;AS-9198;4,5-Dimethoxy-2-nitrocinnamic acid, 97%;(E)-3-(4,5-DIMETHOXY-2-NITROPHENYL)-2-PROPENOIC ACID;155814-18-9;J-013426;F71489;(E)-3-(4,5-dimethoxy-2-nitrophenyl)acrylic acid;A814701;SCHEMBL1615042;AKOS003292909;2-Propenoic acid, 3-(4,5-dimethoxy-2-nitrophenyl)-;InChI=1/C11H11NO6/c1-17-9-5-7(3-4-11(13)14)8(12(15)16)6-10(9)18-2/h3-6H,1-2H3,(H,13,14)/b4-3;AKOS015894319;20567-38-8;(2E)-3-(4,5-dimethoxy-2-nitrophenyl)prop-2-enoic acid;(E)-3-(4,5-dimethoxy-2-nitrophenyl)prop-2-enoic acid;MFCD00017017;(E)-3-(4, 5-dimethoxy-2-nitrophenyl)prop-2-enoic acid;

标识符

MDL:
MFCD00017017
InChIKey:
BZIRMMAJZSOLEW-ONEGZZNKSA-N
Inchi:
1S/C11H11NO6/c1-17-9-5-7(3-4-11(13)14)8(12(15)16)6-10(9)18-2/h3-6H,1-2H3,(H,13,14)/b4-3+
SMILES:
O(C)C1=CC(/C=C/C(=O)O)=C(C=C1OC)[N+](=O)[O-]

4,5-二甲氧基-2-硝基肉桂酸(20567-38-8)物化性质

实验特性

  • LogP : 2.23300
  • PSA : 101.58000
  • 折射率 : 1.5300 (estimate)
  • 沸点 : 483 ºC
  • 熔点 : 293 °C (dec.) (lit.)
  • 闪点 : 246 ºC
  • 颜色与性状 : 未确定
  • 溶解性 : 未确定
  • 密度 : 1.369

计算特性

  • 精确分子量 : 253.05900
  • 氢键供体数量 : 1
  • 氢键受体数量 : 4
  • 可旋转化学键数量 : 5
  • 同位素质量 : 253.059
  • 重原子数量 : 18
  • 复杂度 : 331
  • 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 : 1
  • 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
  • 表面电荷 : 0
  • 拓扑分子极性表面积 : 102

4,5-二甲氧基-2-硝基肉桂酸(20567-38-8)安全信息

4,5-二甲氧基-2-硝基肉桂酸(20567-38-8)海关数据

海关编码:
2918990090
海关数据:

中国海关编码:

2918990090

概述:

2918990090. 其他含其他附加含氧基羧酸(包括酸酐、酰卤化物、过氧化物和过氧酸及该税号的衍生物). 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:30.0%

申报要素:

品名, 成分含量, 用途

Summary:

2918990090. other carboxylic acids with additional oxygen function and their anhydrides, halides, peroxides and peroxyacids; their halogenated, sulphonated, nitrated or nitrosated derivatives. VAT:17.0%. Tax rebate rate:13.0%. . MFN tariff:6.5%. General tariff:30.0%

4,5-二甲氧基-2-硝基肉桂酸(20567-38-8)推荐厂家 更多厂家(31)

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湖北万得化工有限公司 15827180502
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湖北广奥生物科技有限公司 13657291602
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湖北鑫红利化工有限公司 15172537016
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天门恒昌化工有限公司 15102714773
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上海瀚思化工有限公司 18939883912
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顾经理 3003949364
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4,5-二甲氧基-2-硝基肉桂酸(20567-38-8)上下游

4,5-二甲氧基-2-硝基肉桂酸(20567-38-8) MSDS

基础信息

Name:4 5-Dimethoxy-2-Nitrocinnamic Acid 97% Material Safety Data Sheet
Synonym:3-(4,5-Dimethoxy-2-Nitrophenyl)acrylic Acid
CAS:20567-38-8
Section 1 - Chemical Product ? MSDS Name:4 5-Dimethoxy-2-Nitrocinnamic Acid 97% Material Safety Data Sheet
Synonym:3-(4,5-Dimethoxy-2-Nitrophenyl)acrylic Acid

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS
CAS#Chemical NamecontentEINECS#
20567-38-84,5-Dimethoxy-2-Nitrocinnamic Acid97%unlisted
Hazard Symbols: None Listed.
Risk Phrases: None Listed.

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
The toxicological properties of this material have not been fully investigated.
Potential Health Effects
Eye:
May cause eye irritation.
Skin:
May cause skin irritation.
Ingestion:
May cause irritation of the digestive tract. The toxicological properties of this substance have not been fully investigated.
Inhalation:
May cause respiratory tract irritation. The toxicological properties of this substance have not been fully investigated.
Chronic:
No information found.

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. Wash clothing before reuse.
Ingestion:
Never give anything by mouth to an unconscious person. Get medical aid. Do NOT induce vomiting. If conscious and alert, rinse mouth and drink 2-4 cupfuls of milk or water. 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. During a fire, irritating and highly toxic gases may be generated by thermal decomposition or combustion.
Extinguishing Media:
Use agent most appropriate to extinguish fire. Use water spray, dry chemical, carbon dioxide, or appropriate 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. Clean up spills immediately, observing precautions in the Protective Equipment section. Avoid generating dusty conditions.
Provide ventilation.

Section 7 - HANDLING and STORAGE
? Handling:
Wash thoroughly after handling. Use with adequate ventilation.
Minimize dust generation and accumulation. Avoid contact with eyes, skin, and clothing. Keep container tightly closed. Avoid ingestion and inhalation.
Storage:
Store in a tightly closed container. Store in a cool, dry, well-ventilated area away from incompatible substances.

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# 20567-38-8: Personal Protective Equipment Eyes: Wear appropriate protective eyeglasses or chemical safety goggles as described by OSHA's eye and face protection regulations in 29 CFR 1910.133 or European Standard EN166.
Skin:
Wear appropriate protective gloves to prevent skin exposure.
Clothing:
Wear appropriate protective clothing to prevent skin exposure.
Respirators:
A respiratory protection program that meets OSHA's 29 CFR 1910.134 and ANSI Z88.2 requirements or European Standard EN 149 must be followed whenever workplace conditions warrant respirator use.

Section 9 - PHYSICAL AND CHEMICAL PROPERTIES
?
Physical State: Solid
Color: Not available.
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: > 270 deg C
Autoignition Temperature: Not applicable.
Flash Point: Not applicable.
Explosion Limits, lower: Not available.
Explosion Limits, upper: Not available.
Decomposition Temperature:
Solubility in water:
Specific Gravity/Density:
Molecular Formula: C11H11NO6
Molecular Weight: 253.21

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Stable at room temperature in closed containers under normal storage and handling conditions.
Conditions to Avoid:
Incompatible materials, dust generation, excess heat.
Incompatibilities with Other Materials:
Oxidizing agents.
Hazardous Decomposition Products:
Nitrogen oxides, carbon monoxide, irritating and toxic fumes and gases, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 20567-38-8 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
4,5-Dimethoxy-2-Nitrocinnamic 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
Not regulated as a hazardous material.
IMO
Not regulated as a hazardous material.
RID/ADR
Not regulated as a hazardous material.

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.
S 28A After contact with skin, wash immediately with
plenty of water.
S 37 Wear suitable gloves.
S 45 In case of accident or if you feel unwell, seek
medical advice immediately (show the label where
possible).
WGK (Water Danger/Protection)
CAS# 20567-38-8: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 20567-38-8 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 20567-38-8 is not listed on the TSCA inventory.
It is for research and development use only.


SECTION 16 - ADDITIONAL INFORMATION
N/A