3368-21-6 (4-异丙基肉桂酸,3-(4-Isopropylphenyl)acrylic Acid)

快速询单

结构式：

4-异丙基肉桂酸MOL文件

CAS号：

3368-21-6

中文名称：

4-异丙基肉桂酸

英文名称：

3-(4-Isopropylphenyl)acrylic Acid

分子式：

C₁₂H₁₄O₂

分子量：

190.238363742828

4-异丙基肉桂酸(3368-21-6)名称与标识符

名称

中文别名：

4-异丙基肉桂酸;4-异丙基肉桂酸, 主要为反式;4-异丙基肉硅酸;

英文别名：

4-Isopropylcinnamic acid;3-(4-Isopropylphenyl)acrylic acid;4-isopropyl-cinnamic acid;4-iso-Propylcinnamic acid;4-Isopropyl-zimtsaeure;Cuminalessigsaeure;p-isopropylcinnamic acid;p-Isopropyl-zimtsaeure;RARECHEM AL BK 0112;3-[4-(1-Methylethyl)phenyl]-2-propenoic acid;NSC 216;SCHEMBL1711780;(E)-3-(4-Isopropyl-phenyl)-acrylic acid;CHEMBL1391961;NSC-216;HMS1577J21;2-Propenoic acid, 3-(4-(1-methylethyl)phenyl)-;EN300-10955;Z2311574705;NCGC00246519-01;UNII-F64WLF2L8G;3-[4-(propan-2-yl)phenyl]prop-2-enoic acid;2-Propenoic acid, 3-[4-(1-methylethyl)phenyl]-;(2E)-3-[4-(propan-2-yl)phenyl]prop-2-enoic acid;BB 0323216;AKOS025310075;(E)-3-(4-isopropylphenyl)acrylic acid;F3095-3193;SCHEMBL819055;2-Propenoic acid,3-[4-(1-methylethyl)phenyl]-;HMS2753N04;2-Propenoic acid, 3-[4-(1-methylethyl)phenyl]-, (2E)-;trans-4-Isopropylcinnamic acid;(E)-3-(4-propan-2-ylphenyl)prop-2-enoic acid;3368-21-6;2-Propenoic acid, 3-(4-(1-methylethyl)phenyl)-, (2E)-;AI3-23710;4-isopropyl-trans-cinnamic acid;SMR000414813;4-Isopropylcinnamic Acid, Predominantly Trans;EN300-305980;MFCD00016544;CS-0154280;Cinnamic acid, p-isopropyl-;NSC216;EINECS 222-138-2;4-Isopropylzimtsaure;A821905;J-501923;Opera_ID_1705;F64WLF2L8G;NS00048466;116373-36-5;MLS000806999;AKOS000263464;(E)-3-(4-isopropylphenyl)acrylicacid;11R-0617;F15986;(E)-3-(4-isopropylphenyl)prop-2-enoic acid;BRD-K99320527-001-10-2;STK083676;BBL012068;ALBB-011727;Cinnamic acid, p-isopropyl- (7CI,8CI); 3-[4-(1-Methylethyl)phenyl]-2-propenoic acid; 3-(4-Isopropylphenyl)-2-propenoic acid; 4-Isopropylcinnamic acid; NSC 216; p-Isopropylcinnamic acid;

标识符

MDL：

MFCD00016544

InChIKey：

SJDOOXOUSJDYFE-VMPITWQZSA-N

Inchi：

1S/C12H14O2/c1-9(2)11-6-3-10(4-7-11)5-8-12(13)14/h3-9H,1-2H3,(H,13,14)/b8-5+

SMILES：

OC(/C=C/C1C=CC(=CC=1)C(C)C)=O

BRN：

2046679

4-异丙基肉桂酸(3368-21-6)物化性质

实验特性

LogP : 2.90780
PSA : 37.30000
沸点 : 317 ºC
熔点 : 165 ºC
闪点 : 222 ºC
颜色与性状 : 固体
溶解性 : 未确定
密度 : 1.086

计算特性

精确分子量 : 190.09900
氢键供体数量 : 1
氢键受体数量 : 2
可旋转化学键数量 : 3
同位素质量 : 190.099
重原子数量 : 14
复杂度 : 210
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） : 3.3
表面电荷 : 0
拓扑分子极性表面积 : 37.3

4-异丙基肉桂酸(3368-21-6)安全信息

4-异丙基肉桂酸(3368-21-6)国际标准相关数据

EINECS：

222-138-2

4-异丙基肉桂酸(3368-21-6)海关数据

海关编码：

2916399090

海关数据：

中国海关编码：

2916399090

概述：

2916399090 其他芳香一元羧酸. 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, 丙烯酸、丙烯酸盐或酯应报明包装

Summary：

2916399090 other aromatic monocarboxylic acids, their anhydrides, halides, peroxides, peroxyacids and their derivatives VAT:17.0% Tax rebate rate:9.0% Supervision conditions:none MFN tariff:6.5% General tariff:30.0%

4-异丙基肉桂酸(3368-21-6)推荐厂家更多厂家(17)

公司名称	手机号/电话	联系人	QQ	询单
上海源叶生物科技有限公司	15026964105 15026964105	汤思磊	2881489226	询单
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赫澎（上海）生物科技有限公司	13122891558 186-16545970	张硕	3418426269	询单
金锦乐（湖南）化学有限公司		金锦乐	1226360695	询单
JACS-郑州杰克斯化工产品有限公司	15981966935 0371-86259281	杰克斯JACS	893596907	询单

4-异丙基肉桂酸(3368-21-6)相关文献

1. The efficient and selective catalytic oxidation of para-substituted cinnamic acid derivatives by the cytochrome P450 monooxygenase, CYP199A4
Rebecca R. Chao,James J. De Voss,Stephen G. Bell RSC Adv. 2016 6 55286
2. Dioxirane chemistry. Part15. Rate studies on epoxidations by dimethyldioxirane
Robert W. Murray,Dawn L. Shiang J. Chem. Soc. Perkin Trans. 2 1990 349

4-异丙基肉桂酸(3368-21-6) MSDS

基础信息

Name:	4-Isopropylcinnamic acid 98% Material Safety Data Sheet
Synonym:
CAS:	3368-21-6

Section 1 - Chemical Product ? MSDS Name:4-Isopropylcinnamic acid 98% Material Safety Data Sheet
Synonym:

Section 2 - COMPOSITION, INFORMATION ON INGREDIENTS

CAS#	Chemical Name	content	EINECS#
3368-21-6	4-Isopropylcinnamic acid	98%	222-138-2

Hazard Symbols: XI
Risk Phrases: 36/37/38

Section 3 - HAZARDS IDENTIFICATION
? EMERGENCY OVERVIEW
Irritating to eyes, respiratory system and skin.
Potential Health Effects
Eye:
Causes eye irritation.
Skin:
Causes skin irritation. May be harmful if absorbed through the skin.
Ingestion:
May cause irritation of the digestive tract. May be harmful if swallowed.
Inhalation:
Causes 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. If not breathing, give artificial respiration. If breathing is difficult, give oxygen. Get medical aid.
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:
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# 3368-21-6: 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: Crystalline powder
Color: white
Odor: Not available.
pH: Not available.
Vapor Pressure: Not available.
Viscosity: Not available.
Boiling Point: Not available.
Freezing/Melting Point: 157 - 161 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: Insoluble.
Specific Gravity/Density:
Molecular Formula: C12H14O2
Molecular Weight: 190.24

Section 10 - STABILITY AND REACTIVITY
? Chemical Stability:
Not available.
Conditions to Avoid:
Incompatible materials.
Incompatibilities with Other Materials:
Strong oxidizing agents.
Hazardous Decomposition Products:
Carbon monoxide, carbon dioxide.
Hazardous Polymerization: Has not been reported

Section 11 - TOXICOLOGICAL INFORMATION
? RTECS#:
CAS# 3368-21-6 unlisted.
LD50/LC50:
Not available.
Carcinogenicity:
4-Isopropylcinnamic 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: XI
Risk Phrases:
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 37/39 Wear suitable gloves and eye/face
protection.
WGK (Water Danger/Protection)
CAS# 3368-21-6: No information available.
Canada
None of the chemicals in this product are listed on the DSL/NDSL list.
CAS# 3368-21-6 is not listed on Canada's Ingredient Disclosure List.
US FEDERAL
TSCA
CAS# 3368-21-6 is not listed on the TSCA inventory.
It is for research and development use only.

SECTION 16 - ADDITIONAL INFORMATION
N/A