Suitable for microbiology Suitable for microbiology for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships Normal Check lot-specific COA for exact specifications.
SDS, COA, datasheet, and spec sheet available for download. Lot-specific COA accessible via lot number lookup.
Cited in 8 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
| Canonical Smiles | CN(C)C1=CC=C(C=C1)C=CC=O |
|---|---|
| IUPAC Name | (E)-3-[4-(dimethylamino)phenyl]prop-2-enal |
| InChIKey | RUKJCCIJLIMGEP-ONEGZZNKSA-N |
| INCHI | 1S/C11H13NO/c1-12(2)11-7-5-10(6-8-11)4-3-9-13/h3-9H,1-2H3/b4-3+ |
| Isomeric SMILES | CN(C)C1=CC=C(C=C1)/C=C/C=O |
| WGK Germany | 3 |
| Molecular Weight | 175.23 |
| Beilstein | 972369 |
| Reaxy-Rn | 972369 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=972369&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Phenylpropanoids and polyketides |
| Class | Cinnamaldehydes |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Cinnamaldehydes |
| Alternative Parents | Styrenes Dialkylarylamines Aniline and substituted anilines Enals Organopnictogen compounds Organic oxides Hydrocarbon derivatives Aldehydes |
| Molecular Framework | Aromatic homomonocyclic compounds |
| Substituents | Cinnamaldehyde - Styrene - Tertiary aliphatic/aromatic amine - Dialkylarylamine - Aniline or substituted anilines - Benzenoid - Monocyclic benzene moiety - Alpha,beta-unsaturated aldehyde - Enal - Tertiary amine - Amine - Aldehyde - Organooxygen compound - Organonitrogen compound - Organic nitrogen compound - Carbonyl group - Hydrocarbon derivative - Organic oxide - Organopnictogen compound - Organic oxygen compound - Aromatic homomonocyclic compound |
| Description | This compound belongs to the class of organic compounds known as cinnamaldehydes. These are organic aromatic compounds containing a cinnamlaldehyde moiety, consisting of a benzene and an aldehyde group to form 3-phenylprop-2-enal. |
| External Descriptors | Not available |
| Melt Point(°C) | 140°C |
|---|---|
| Molecular Weight | 175.230 g/mol |
| XLogP3 | 2.300 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 2 |
| Rotatable Bond Count | 3 |
| Exact Mass | 175.1 Da |
| Monoisotopic Mass | 175.1 Da |
| Topological Polar Surface Area | 20.300 Ų |
| Heavy Atom Count | 13 |
| Formal Charge | 0 |
| Complexity | 179.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 1 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 1 |
| Covalently-Bonded Unit Count | 1 |
| 1. Anqi Liu, Qipeng Zhang, Lei Pan, Fan Yang, Dan Lin, Changlong Jiang. (2024) Donor–Acceptor Type Solvatochromic Flavonoid Materials Fluorphores for Polarity Sensing and Real-Time Temperature Monitoring. ADVANCED FUNCTIONAL MATERIALS, [PMID:] [10.1002/adfm.202415250] |
| 2. Binghong Gao, Chuanyan Rao, Xingmeng Lei, Siqi Li, Xiaochuan Huang, Yanlin Liu, Dongqing Ye. (2025) Evaluating different chain conformation of mannoproteins during encapsulation of grape seed extract. FOOD CHEMISTRY, [PMID:39952170] [10.1016/j.foodchem.2025.143374] |
| 3. Binghong Gao, Xingmeng Lei, Xiaochuan Huang, Chuanyan Rao, Yi Qin, Yuyang Song, Dongqing Ye, Yanlin Liu. (2025) The enhancement mechanism of gum Acacia and mannoproteins through hydrogen bonding and the development strategy for taste-masking films. FOOD HYDROCOLLOIDS, [PMID:] [10.1016/j.foodhyd.2025.111216] |
| 4. Yunlong Pang, Shanshan Li, Qiang Yan, Pingping Zhang, Yu Lu, Cunyuan Zhao, Tao Li, Hailiang Zhao, Shanyi Sun, Tingting Zhou, Xiaoqian Wang, Huaqiang Zhu, Yong Li, Lingrang Kong, Guihua Bai, Shubing Liu, Yuye Wu. (2025) Genetic architecture of condensed tannins accumulated in wheat grains. Crop Journal, [PMID:] [10.1016/j.cj.2025.09.005] |
| 5. Xuehao Ma, Xilang Jin, Haiyan Bai, Liyuan Ma, Xiao Li, Xingliang Fang, Weixing Chen, Mengyao She. (2023) Visual detection of water content in liquor with near-infrared fluorescence sensor assisted by smartphone. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, [PMID:38134656] [10.1016/j.saa.2023.123791] |
| 6. Qinghao Zhao, Guorong Du, Pengtao Zhao, Anque Guo, Xiaomeng Cao, Chenyaqiong Cheng, Hui Liu, Fei Wang, Yuefan Zhao, Yan Liu, Xiaoyu Wang. (2023) Investigating wine astringency profiles by characterizing tannin fractions in Cabernet Sauvignon wines and model wines. FOOD CHEMISTRY, [PMID:36821921] [10.1016/j.foodchem.2023.135673] |
| 7. Wenfei Ren, Yuan Liu, Baiyi Zu, Jiguang Li, Da Lei, Tianshi Zhang, Xincun Dou. (2022) Ultrasensitive and rapid colorimetric detection of urotropin boosted by effective electrostatic probing and non-covalent sampling. JOURNAL OF HAZARDOUS MATERIALS, [PMID:35739781] [10.1016/j.jhazmat.2022.129263] |
| 8. Wen-Jia Zhang, Li Fan, Zeng-Bo Li, Ting Ou, Hua-Jin Zhai, Jun Yang, Chuan Dong, Shao-Min Shuang. (2016) Thiazole-based ratiometric fluorescence pH probe with large Stokes shift for intracellular imaging. SENSORS AND ACTUATORS B-CHEMICAL, [PMID:] [10.1016/j.snb.2016.04.122] |
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