Determine the necessary mass, volume, or concentration for preparing a solution.
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
≥98% for sensitive chromatographic and analytical workflows requiring minimal baseline interference.
Room temperature Ships FedEx DG Service 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 100 peer-reviewed publications across chromatography, organic synthesis, and cross-coupling reactions.
2-Heptanone, a volatile organic compound, belongs to a class of odorous ketones. The impact of 2-heptanone on the behavioral responses of worker honeybees has been reported. The kinetic of reduction of 2-heptanone by samarium iodide in the presence of hexamethylphosphoramide has been analyzed by gas chromatography (GC).
| Pubchem Sid | 488180668 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488180668 |
| Sonrisas canónicas | CCCCCC(=O)C |
| IUPAC Name | heptan-2-one |
| InChIKey | CATSNJVOTSVZJV-UHFFFAOYSA-N |
| INCHI | 1S/C7H14O/c1-3-4-5-6-7(2)8/h3-6H2,1-2H3 |
| Isómeros SMILES | CCCCCC(=O)C |
| WGK Alemania | 1 |
| RTECS | MJ5075000 |
| Número ONU | 1110 |
| Grupo de embalaje | III |
| Peso molecular | 114.19 |
| Beilstein | 1699063 |
| Reaxy-Rn | 1699063 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1699063&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 | Organic oxygen compounds |
| Clase | Organooxygen compounds |
| Subclass | Carbonyl compounds |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Ketones |
| Alternative Parents | Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aliphatic acyclic compounds |
| Substituents | Ketone - Organic oxide - Hydrocarbon derivative - Aliphatic acyclic compound |
| Descripción | This compound belongs to the class of organic compounds known as ketones. These are organic compounds in which a carbonyl group is bonded to two carbon atoms R2C=O (neither R may be a hydrogen atom). Ketones that have one or more alpha-hydrogen atoms undergo keto-enol tautomerization, the tautomer being an enol. |
| External Descriptors | Oxygenated hydrocarbons |
| Activity Type | Relation | Activity value | Units | Action Type | Journal | PubMed Id | doi | Assay Aladdin ID |
|---|
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Fecha | Articulo |
|---|---|---|---|
| Certificate of Analysis | Sep 09, 2025 | H103803 | |
| Certificate of Analysis | Aug 13, 2025 | H103803 | |
| Certificate of Analysis | Apr 03, 2025 | H103803 | |
| Certificate of Analysis | Jan 13, 2025 | H103803 | |
| Certificate of Analysis | Jan 13, 2025 | H103803 | |
| Certificate of Analysis | Jan 13, 2025 | H103803 | |
| Certificate of Analysis | Jan 13, 2025 | H103803 | |
| Certificate of Analysis | Jan 13, 2025 | H103803 | |
| Certificate of Analysis | Jan 13, 2025 | H103803 | |
| Certificate of Analysis | Oct 09, 2024 | H103803 | |
| Certificate of Analysis | Oct 09, 2024 | H103803 | |
| Certificate of Analysis | Oct 09, 2024 | H103803 | |
| Certificate of Analysis | Feb 26, 2024 | H103803 | |
| Certificate of Analysis | Feb 26, 2024 | H103803 | |
| Certificate of Analysis | Feb 26, 2024 | H103803 | |
| Certificate of Analysis | Feb 26, 2024 | H103803 | |
| Certificate of Analysis | Feb 26, 2024 | H103803 | |
| Certificate of Analysis | Feb 26, 2024 | H103803 | |
| Certificate of Analysis | Oct 20, 2022 | H103803 | |
| Certificate of Analysis | Oct 20, 2022 | H103803 | |
| Certificate of Analysis | Oct 20, 2022 | H103803 | |
| Certificate of Analysis | Oct 20, 2022 | H103803 | |
| Certificate of Analysis | Dec 04, 2021 | H103803 |
| Solubilidad | Slightly miscible with water. |
|---|---|
| Sensibilidad | heat sensitive |
| Índice de refracción | 1.408 |
| Punto de inflamación (°C) | 39℃ |
| Punto de ebullición (°C) | 151.5°C |
| Punto de fusión (°C) | -35.5°C |
| Peso molecular | 114.190 g/mol |
| XLogP3 | 2.000 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 4 |
| Exact Mass | 114.104 Da |
| Monoisotopic Mass | 114.104 Da |
| Topological Polar Surface Area | 17.100 Ų |
| Heavy Atom Count | 8 |
| Formal Charge | 0 |
| Complexity | 66.800 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
| 1. Yilin Li, Houyin Wang, Ruotong Li, Guirong Liu, Kui Zhong, Lipeng Gao, Baoqing Zhu, Anwen Jin, Bolin Shi, Lei Zhao, Sisi Wang. (2023) Monitoring volatile changes in infant formula during long-term storage at room temperature. Current Research in Food Science, [PMID:38077467] [10.1016/j.crfs.2023.100645] |
| 2. Haitang Wang, Hongwei Zhang, Qian Liu, Xiufang Xia, Qian Chen, Baohua Kong. (2022) Exploration of interaction between porcine myofibrillar proteins and selected ketones by GC–MS, multiple spectroscopy, and molecular docking approaches. FOOD RESEARCH INTERNATIONAL, [PMID:36076437] [10.1016/j.foodres.2022.111624] |
| 3. Xin Geng, Zhengyan Zhao, Hongli Li, David Da Yong Chen. (2021) Tee-Shaped Sample Introduction Device Coupled with Direct Analysis in Real-Time Mass Spectrometry for Gaseous Analytes. ANALYTICAL CHEMISTRY, [PMID:34825821] [10.1021/acs.analchem.1c03281] |
| 4. Shuang Chen, Jialing Lu, Michael Qian, Hongkui He, Anjun Li, Jun Zhang, Xiaomei Shen, Jiangjing Gao, Yan Xu. (2021) Untargeted Headspace-Gas Chromatography-Ion Mobility Spectrometry in Combination with Chemometrics for Detecting the Age of Chinese Liquor (Baijiu). Foods, 10 (11): (2888). [PMID:34829169] [10.3390/foods10112888] |
| 5. Zhang Xiaofang, Wang Liuyang, Liu Chunqin, Liu Yongqiang, Mei Xiangdong, Wang Zhongyue, Zhang Tao. (2021) Identification and field verification of an aggregation pheromone from the white-spotted flower chafer, Protaetia brevitarsis Lewis (Coleoptera: Scarabaeidae). Scientific Reports, 11 (1): (1-10). [PMID:34785739] [10.1038/s41598-021-01887-y] |
| 6. Chen Liu, Ping Yang, Haili Wang, Huanlu Song. (2021) Identification of odor compounds and odor-active compounds of yogurt using DHS, SPME, SAFE, and SBSE/GC-O-MS. LWT-FOOD SCIENCE AND TECHNOLOGY, [PMID:] [10.1016/j.lwt.2021.112689] |
| 7. Jinguang Liu, Yuqian Liu, Anqi Wang, Zhen Dai, Rui Wang, Hui Sun, Padraig Strappe, Zhongkai Zhou. (2021) Characteristics of moisture migration and volatile compounds of rice stored under various storage conditions. JOURNAL OF CEREAL SCIENCE, [PMID:] [10.1016/j.jcs.2021.103323] |
| 8. Jinguang Liu, Yuqian Liu, Meng Jia, Xuedong Kang, Saimin Wang, Hui Sun, Meng Liu, Anqi Wang, Padraig Strappe, Zhongkai Zhou. (2021) Association of enriched metabolites profile with the corresponding volatile characteristics induced by rice yellowing process. FOOD CHEMISTRY, [PMID:33582543] [10.1016/j.foodchem.2021.129173] |
| 9. Chao Wang, Zhongrong He, Chenxia Zhang, Liping Du, Dongguang Xiao, Yongquan Xu. (2020) Sensory and instrumental analysis-guided exploration of odor-active compounds recovery with oil during the water-boiling extraction of Pu-erh tea. FOOD RESEARCH INTERNATIONAL, [PMID:32517926] [10.1016/j.foodres.2020.109243] |
| 10. Hui Shen, Mingquan Huang, Mouming Zhao, Weizheng Sun. (2019) Interactions of selected ketone flavours with porcine myofibrillar proteins: The role of molecular structure of flavour compounds. FOOD CHEMISTRY, [PMID:31261004] [10.1016/j.foodchem.2019.125060] |
| 11. Jianlin Peng, Meiling Qi. (2018) Poly(3-hexylthiophene) stationary phase for gas chromatographic separations of aliphatic and aromatic isomers. JOURNAL OF CHROMATOGRAPHY A, [PMID:30031537] [10.1016/j.chroma.2018.07.047] |
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| 15. Yunzi Feng, Guowan Su, Haifeng Zhao, Yu Cai, Chun Cui, Dongxiao Sun-Waterhouse, Mouming Zhao. (2014) Characterisation of aroma profiles of commercial soy sauce by odour activity value and omission test. FOOD CHEMISTRY, [PMID:25148982] [10.1016/j.foodchem.2014.06.057] |
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| 57. Yunzi Feng, Yu Cai, Guowan Su, Haifeng Zhao, Chenxia Wang, Mouming Zhao. (2013) Evaluation of aroma differences between high-salt liquid-state fermentation and low-salt solid-state fermentation soy sauces from China. FOOD CHEMISTRY, [PMID:24128458] [10.1016/j.foodchem.2013.07.072] |
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