计算溶液所需的质量、体积或浓度。
| 活性类型 | 活性值-log(M) | 作用机制 | 期刊 | 参考文献(PubMed IDs) |
|---|
为什么选择此级别
，适用于对基线干扰要求严格的色谱和分析工作流程。
储存与运输
-80℃储存。特低温运输 。请查阅批次 COA 获取详细规格。
质量文档
SDS、COA、产品数据表及规格说明书均可下载。可通过批号查询获取批次 COA。
文献证明
在色谱分析、有机合成和交叉偶联反应领域已被 19 篇同行评审文献引用。
概述
溶于醇、氯仿，微溶于水。有特殊的肉桂芳香气味，能随水蒸汽挥发。天然品和合成品都是反式结构。
规格
别名
反式肉桂醛, 3-苯基-2-丙烯醛
英文别名
cinnamaldehyde | trans-Cinnamaldehyde | 104-55-2 | 14371-10-9 | Cinnamic aldehyde | 3-Phenylacrylaldehyde | Cinnamal | (E)-Cinnamaldehyde | Zimtaldehyde | (2E)-3-phenylprop-2-enal | 3-Phenylpropenal | 2-Propenal, 3-phenyl- | Phenylacrolein | trans-Cinnamic aldehyde | Cinnamylaldehyd
规格或纯度
10mM in DMSO
英文名称
trans-Cinnamaldehyde
储存条件
-80℃储存
运输条件
特低温运输
名称和识别符
PubChem SID
EC号
604-377-8
分子类型
小分子
IUPAC Name
(E)-3-phenylprop-2-enal
INCHI
1S/C9H8O/c10-8-4-7-9-5-2-1-3-6-9/h1-8H/b7-4+
InChi Key
KJPRLNWUNMBNBZ-QPJJXVBHSA-N
Smiles
C1=CC=C(C=C1)C=CC=O
Isomeric SMILES
C1=CC=C(C=C1)/C=C/C=O
分子量
132.16
Beilstein号
7348
Reaxy-Rn
605737
Reaxys-RN link address
https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=605737&ln=
技术文档
高级数据
系统学分类
分类树（Taxonomy Tree）
| 界（kingdom) | 有机化合物 |
|---|---|
| 超类（Superclass) | 苯丙素类和聚酮类 |
| 类（Class) | 肉桂醛 |
| 亚类（Subclass） | 暂无 |
| 中间层级节点（Intermediate Tree Nodes） | 暂无 |
| 直接上位类(Direct Parent) | 肉桂醛 |
| 其他上位类（Alternative Parents） | 苯乙烯 埃纳尔斯 有机氧化物 碳氢化合物衍生物 醛类 |
| 分子骨架（Molecular Framework) | 芳香族同单环化合物 |
| 取代基（Substituents） | 醛 - α,β-不饱和醛 - 芳香族同单环化合物 - 苯基化合物 - 羰基 - 肉桂醛 - 萘醌 - 烃衍生物 - 单环苯基基团 - 有机氧化物 - 有机氧化合物 - 有机氧化合物 - 苯乙烯 |
| 描述（Description） | 该化合物属于有机化合物中的肉桂醛类。这类芳香族有机化合物含有肉桂醛基团，由苯环与醛基结合形成3-苯基-2-丙烯醛。 |
| 外部描述符（External Descriptors） | Monolignols |
三维结构
交互式化学结构模型
关联靶点（人）
TRPA1
Tclin
瞬时受体电位阳离子通道亚家族A成员1(Transient receptor potential cation channel subfamily A member 1)
(3 活性数据)
PDE5A
Tclin
Phosphodiesterase 5A
(5113 活性数据)
EGFR
Tclin
Epidermal growth factor receptor erbB1
(33727 活性数据)
CA2
Tclin
Carbonic anhydrase II
(17698 活性数据)
ESR1
Tclin
Estrogen receptor alpha
(17718 活性数据)
HMGCR
Tclin
HMG-CoA reductase
(2475 活性数据)
NR3C1
Tclin
Glucocorticoid receptor
(14987 活性数据)
INSR
Tclin
Insulin receptor
(5558 活性数据)
PGR
Tclin
Progesterone receptor
(8562 活性数据)
ADRB2
Tclin
Beta-2 adrenergic receptor
(11824 活性数据)
CHRM2
Tclin
Muscarinic acetylcholine receptor M2
(10671 活性数据)
ADRB1
Tclin
Beta-1 adrenergic receptor
(6630 活性数据)
HTR1A
Tclin
Serotonin 1a (5-HT1a) receptor
(14969 活性数据)
ADRA2A
Tclin
Alpha-2a adrenergic receptor
(9450 活性数据)
ALOX5
Tclin
Arachidonate 5-lipoxygenase
(6568 活性数据)
AR
Tclin
Androgen Receptor
(11781 活性数据)
CHRM1
Tclin
Muscarinic acetylcholine receptor M1
(12690 活性数据)
ACE
Tclin
Angiotensin-converting enzyme
(1423 活性数据)
DRD2
Tclin
Dopamine D2 receptor
(23596 活性数据)
TYR
Tclin
Tyrosinase
(717 活性数据)
MAOA
Tclin
Monoamine oxidase A
(11911 活性数据)
CNR1
Tclin
Cannabinoid CB1 receptor
(20913 活性数据)
DRD1
Tclin
Dopamine D1 receptor
(9720 活性数据)
DRD4
Tchem
Dopamine D4 receptor
(7907 活性数据)
ACHE
Tclin
Acetylcholinesterase
(18204 活性数据)
PTGS1
Tclin
Cyclooxygenase-1
(9233 活性数据)
SLC6A2
Tclin
Norepinephrine transporter
(10102 活性数据)
HRH2
Tclin
Histamine H2 receptor
(5428 活性数据)
ADRA1D
Tclin
Alpha-1d adrenergic receptor
(4171 活性数据)
HTR1B
Tclin
Serotonin 1b (5-HT1b) receptor
(2801 活性数据)
HTR2A
Tclin
Serotonin 2a (5-HT2a) receptor
(14758 活性数据)
HTR2C
Tclin
Serotonin 2c (5-HT2c) receptor
(11471 活性数据)
SLC6A1
Tclin
GABA transporter 1
(308 活性数据)
ADORA1
Tclin
Adenosine A1 receptor
(17603 活性数据)
CALCR
Tclin
Calcitonin receptor
(2215 活性数据)
SLC6A4
Tclin
Serotonin transporter
(12625 活性数据)
ADRA1A
Tclin
Alpha-1a adrenergic receptor
(8359 活性数据)
PTGS2
Tclin
Cyclooxygenase-2
(13999 活性数据)
HRH1
Tclin
Histamine H1 receptor
(7573 活性数据)
ADRA1B
Tclin
Alpha-1b adrenergic receptor
(2912 活性数据)
OPRM1
Tclin
Mu opioid receptor
(19785 活性数据)
DRD3
Tclin
Dopamine D3 receptor
(14368 活性数据)
AVPR1A
Tclin
Vasopressin V1a receptor
(5412 活性数据)
OPRD1
Tclin
Delta opioid receptor
(15096 活性数据)
OPRK1
Tclin
Kappa opioid receptor
(16155 活性数据)
XDH
Tclin
Xanthine dehydrogenase
(1038 活性数据)
SLC6A3
Tclin
Dopamine transporter
(10535 活性数据)
PTH1R
Tclin
Parathyroid hormone receptor
(47172 活性数据)
KCNH2
Tclin
HERG
(29587 活性数据)
HTR4
Tclin
Serotonin 4 (5-HT4) receptor
(2068 活性数据)
ESR2
Tclin
Estrogen receptor beta
(9272 活性数据)
关联靶点（其它种属）
Agtr2
Angiotensin II type 2 (AT-2) receptor (803 活性数据)
Mc4r
Melanocortin receptor 4 (1205 活性数据)
Ltc4s
Leukotriene C4 synthase (1 活性数据)
Sigmar1
Sigma opioid receptor (160 活性数据)
Npy1r
Neuropeptide Y receptor type 1 (8 活性数据)
Cckar
Cholecystokinin A receptor (90 活性数据)
Nos2
Nitric oxide synthase, inducible (3573 活性数据)
Mapk1
MAP kinase ERK2 (650 活性数据)
Hdac6
Histone deacetylase 6 (222 活性数据)
Mmp9
Matrix metalloproteinase 9 (38 活性数据)
ftsZ
Cell division protein ftsZ (97 活性数据)
Pseudomonas aeruginosa (123386 活性数据)
Burkholderia cepacia (649 活性数据)
Enterobacter cloacae (7976 活性数据)
Klebsiella pneumoniae (43867 活性数据)
Salmonella typhimurium (15756 活性数据)
Micrococcus luteus (7463 活性数据)
Staphylococcus aureus (210822 活性数据)
Escherichia coli (133304 活性数据)
Aspergillus niger (16508 活性数据)
Bacillus subtilis (32866 活性数据)
Penicillium citrinum (522 活性数据)
Enterococcus faecalis (29875 活性数据)
Pichia kudriavzevii (7448 活性数据)
Candida albicans (78123 活性数据)
Trichophyton rubrum (3646 活性数据)
Ascaris suum (13 活性数据)
Meloidogyne incognita (862 活性数据)
Mus musculus (284745 活性数据)
Rattus norvegicus (775804 活性数据)
RAW264.7 (28094 活性数据)
rep
Replicase polyprotein 1ab (378 活性数据)
Trpa1
Transient receptor potential cation channel subfamily A member 1 (1003 活性数据)
Trpm8
Transient receptor potential cation channel subfamily M member 8 (889 活性数据)
Abutilon theophrasti (831 活性数据)
Aspergillus parasiticus (296 活性数据)
Rhizoctonia solani (2251 活性数据)
Spinal cord (22 活性数据)
Nfe2l2
Nuclear factor erythroid 2-related factor 2 (214 活性数据)
Rorc
Nuclear receptor ROR-gamma (89407 活性数据)
stx1
Shiga toxin (517 活性数据)
Aspergillus sydowii (55 活性数据)
Attelabidae (13 活性数据)
Glra2
Glycine receptor (1745 活性数据)
SARS-CoV-2 (38078 活性数据)
Esophagus (8 活性数据)
luxR
HTH-type transcriptional regulator LuxR (29 活性数据)
作用机制
| 作用机制 | Action Type | target ID | Target Name | Target Type | Target Organism | Binding Site Name | 参考文献 |
|---|
化学和物理性质
折光率
1.6195
闪点(℉)
159.8 °F
闪点(℃)
71℃
沸点
250-252 °C
熔点
-9~-4°C
分子量
132.160 g/mol
XLogP3
1.900
氢键供体数Hydrogen Bond Donor Count
0
氢键受体数Hydrogen Bond Acceptor Count
1
可旋转键计数Rotatable Bond Count
2
精确质量Exact Mass
132.058 Da
单同位素质量Monoisotopic Mass
132.058 Da
拓扑极表面积Topological Polar Surface Area
17.100 Ų
重原子数Heavy Atom Count
10
形式电荷Formal Charge
0
复杂度Complexity
121.000
同位素原子数Isotope Atom Count
0
定义的原子立体中心计数Defined Atom Stereocenter Count
0
未定义的原子立体中心计数Undefined Atom Stereocenter Count
0
定义的键立体中心计数Defined Bond Stereocenter Count
1
未定义的键立体中心计数Undefined Bond Stereocenter Count
0
所有立体化学键的总数The total count of all stereochemical bonds
1
共价键合单元计数Covalently-Bonded Unit Count
1
安全和危险性（GHS）
象形图
信号词
警告
危险声明
H315: 引起皮肤刺激
H317: 可能引起皮肤过敏反应
H319: 引起严重眼睛刺激
H335: 可能引起呼吸道刺激
预防措施声明
P261: 避免吸入灰尘/烟雾/气体/雾/蒸汽/喷雾
P264: 处理后要彻底洗手。
P271: 仅在室外或通风良好的地方使用。
P272: 被污染的工作服不允许离开工作场所
P280: 戴防护手套/穿防护服/戴防护眼罩/戴防护面具。
P321: 特殊处理（请参阅此标签上的...）。
P302+P352: 如皮肤沾染：用水充分清洗。
P304+P340: 如误吸入：将人转移到空气新鲜处，保持呼吸舒适体位。
P305+P351+P338: 如进入眼睛：用水小心冲洗几分钟。如戴隐形眼镜并可方便地取出，取出隐形眼镜。继续冲洗。
P333+P313: 如发生皮肤刺激或皮疹：求医/就诊。
P362+P364: 脱掉沾污的衣服，清洗后方可重新使用。
P405: 密闭存放
P403+P233: 存放在通风良好的地方。保持容器密闭。
P501: 将内容物/容器处理到。。。
P264+P265: 处理后彻底洗手[和…]。不要触摸眼睛。
P337+P317: 如果眼睛刺激持续：寻求医疗帮助。
P332+P317: 如果出现皮肤刺激：请寻求医疗帮助。
P319: 如果你感到不适，请寻求医疗帮助。
WGK Germany
3
RTECS
GD6476000
Merck Index
2297
个人防护装备
Eyeshields, Faceshields, full-face respirator (US), Gloves, multi-purpose combination respirator cartridge (US), type ABEK (EN14387) respirator filter
质检证书（CoA,COO,BSE/TSE 和分析图谱)
C of A & Other Certificates(BSE/TSE, COO):
输入批号以搜索分析图谱:
技术文档和文章
此产品的引用文献
引用文献
| 1. Lingqian Bai, Zhihua Gao, Xiaofeng Xu, Wenxia Lv, Yikui Wang, Kexin Dong, Zhijun Yu, Xiaolong Yang. (2023) The acaricidal activity and enzymatic targets of the essential oils of Cinnamomum cassia and Cinnamomum camphora and their major components against Haemaphysalis longicornis (Acari: Ixodidae). INDUSTRIAL CROPS AND PRODUCTS, [10.1016/j.indcrop.2023.117967] |
| 2. Wenqi Yin, Ruyu Yan, Xiaoyi Zhou, Xiaojing Li, Shangyuan Sang, David Julian McClements, Long Chen, Jie Long, Aiquan Jiao, Jinpeng Wang, Zhengyu Jin, Chao Qiu. (2023) Preparation of robust, water-resistant, antibacterial, and antioxidant chitosan-based films by incorporation of cinnamaldehyde–tannin acid-zinc acetate nanoparticles. FOOD CHEMISTRY, [PMID:37054511] [10.1016/j.foodchem.2023.136004] |
| 3. Nwanade Chuks Fidelis, Wang Min, Yu Zhijun, Liu Jingze. (2023) Biochemical and molecular mechanisms involved in the response of Haemaphysalis longicornis (Acari: Ixodidae) to Cinnamomum cassia essential oil and its major constituent. JOURNAL OF PEST SCIENCE, [10.1007/s10340-023-01602-y] |
| 4. Ting Li, Xi Zhao, Xueli Cao. (2023) Volatile Metabolome and Aroma Differences of Six Cultivars of Prunus mume Blossoms. Plants-Basel, 12 (2): (308). [PMID:36679020] [10.3390/plants12020308] |
| 5. Chuks Fidelis Nwanade, Min Wang, Hongxia Li, Abolfazl Masoudi, Zhijun Yu, Jingze Liu. (2022) Individual and synergistic toxicity of cinnamon essential oil constituents against Haemaphysalis longicornis (Acari: Ixodidae) and their potential effects on non-target organisms. INDUSTRIAL CROPS AND PRODUCTS, [10.1016/j.indcrop.2022.114614] |
| 6. Nwanade Chuks F., Wang Min, Wang Tianhong, Zhang Xiaoyu, Wang Can, Yu Zhijun, Liu Jingze. (2021) Acaricidal activity of Cinnamomum cassia (Chinese cinnamon) against the tick Haemaphysalis longicornis is linked to its content of (E)-cinnamaldehyde. Parasites & Vectors, 14 (1): (1-11). [PMID:34158107] [10.1186/s13071-021-04830-2] |
| 7. Jie Gao, Manqian Zhang, Ruixue Niu, Xue Gu, Erwei Hao, Xiaotao Hou, Jiagang Deng, Gang Bai. (2021) The combination of cinnamaldehyde and kaempferol ameliorates glucose and lipid metabolism disorders by enhancing lipid metabolism via AMPK activation. Journal of Functional Foods, [10.1016/j.jff.2021.104556] |
| 8. Liao Wenting, Jin Qiwen, Liu Junning, Ruan Yiling, Li Xinran, Shen Yueyue, Zhang Zhicheng, Wang Yong, Wu Shengming, Zhang Junying, Kang Lifeng, Wu Chunyong. (2021) Mahuang Decoction Antagonizes Acute Liver Failure via Modulating Tricarboxylic Acid Cycle and Amino Acids Metabolism. Frontiers in Pharmacology, [PMID:33859560] [10.3389/fphar.2021.599180] |
| 9. Jinhao Zhao, Zhongyan Wang, Zhongshan Li, Jiayu Shi, Ling Meng, Guorong Wang, Jingli Cheng, Yongjun Du. (2020) Development of lady beetle attractants from floral volatiles and other semiochemicals for the biological control of aphids. JOURNAL OF ASIA-PACIFIC ENTOMOLOGY, [10.1016/j.aspen.2020.08.005] |
| 10. Mostafa Gouda, Meihu Ma, Long Sheng, Xiaole Xiang. (2019) SPME-GC-MS & metal oxide E-Nose 18 sensors to validate the possible interactions between bio-active terpenes and egg yolk volatiles. FOOD RESEARCH INTERNATIONAL, [PMID:31554071] [10.1016/j.foodres.2019.108611] |
| 11. Pang Xiaomin, Bai Ligai, Wang Zijun, Yang Huijun, Liu Haiyan, Yan Hongyuan. (2019) Establishment of Quantitatively Analytical Methods for the Determination of Aroma Components in Edible Spices Using a Homemade Chromatographic Monolithic Column. CHROMATOGRAPHIA, 82 (9): (1345-1354). [10.1007/s10337-019-03761-6] |
| 12. Mostafa Gouda, Linlin Zu, Sumin Ma, Long Sheng, Meihu Ma. (2018) Influence of bio-active terpenes on the characteristics and functional properties of egg yolk. FOOD HYDROCOLLOIDS, [10.1016/j.foodhyd.2018.02.009] |
| 13. Mostafa Gouda, Shisi Zhang, Yuanyuan Liu, Long Sheng, Meihu Ma. (2017) Effects of four natural antioxidant phenyl terpenes on emulsifying and rheological properties of egg yolk. LWT-FOOD SCIENCE AND TECHNOLOGY, [10.1016/j.lwt.2017.04.075] |
| 14. Zhenhua Jiang, Hong Jiang, Pengfei Xie. (2013) Antifungal activities against Sclerotinia sclerotiorum by Cinnamomum cassia oil and its main components. JOURNAL OF ESSENTIAL OIL RESEARCH, [10.1080/10412905.2013.782475] |
| 15. Ziying Lu, Tong Xing, Zepeng Zhao, Zefeng Li, Dongping Hou, Zhuolin Ma, Siyi Chen, Yuheng Yang, Shaoting Li, Hongmei Zhang. (2024) Induction of Salmonella Enteritidis into a Viable but Nonculturable State by Cinnamaldehyde and Its Resuscitation. Foodborne Pathogens and Disease, [PMID:38695190] [10.1089/fpd.2023.0186] |
| 16. Haoting Yan, Yongwang Ren, Renkun Zhang, Feixiang Chang, Qinhong Wei, Jing Xu. (2023) A One-Pot Hydrothermal Preparation of High Loading Ni/La2O3 Catalyst for Efficient Hydrogenation of Cinnamaldehyde. Catalysts, 13 (2): (298). [10.3390/catal13020298] |
| 17. Hou Guorong, Yun Yanjing, Wang Minqiang, Wang Ying, Chen Hao, Zhang Longcheng, Wang Feng, Xia Qingyou, Liu Yang, Lu Zhisong, Bao Shu-Juan. (2019) A coaxial nanocable textured by a cerium oxide shell and carbon core for sensing nitric oxide. MICROCHIMICA ACTA, 186 (12): (1-8). [PMID:31732798] [10.1007/s00604-019-3839-1] |
| 18. Yuxin Zhang, Jiawei Huangfu, Bin Rong, Xiongfei Du, Yang Hu, Xu Zeng, Kaikai Chen, Changkun Ding, Wenping Hu, Kuo Yuan, Qinglin Huang. (2025) Confined Ostwald ripening approach towards highly durable and flexible 3D PTFE aerogels boosting Pickering emulsion separation in bi-phase photocatalysis. CHEMICAL ENGINEERING JOURNAL, [10.1016/j.cej.2025.169135] |
| 19. Yu-Ning Hu, Di Chen, Tian-Yi Zhang, Jun Ding, Yu-Qi Feng. (2019) Use of ammonium sulfite as a post-column derivatization reagent for rapid detection and quantification of aldehydes by LC-MS. TALANTA, [PMID:31514828] [10.1016/j.talanta.2019.120172] |
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