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Basic Description
| Synonyms | I9H95PVI1P | SCHEMBL52121 | 4-CARBOXALDEHYDE-N-ISOPROPYLBENZAMIDE; n-isopropyl-4-formylbenzamide; 4-formyl-N-isopropylbenzamide | 3-Pyrenylaldehyde | BBL027449 | 3-Formylpyrene | AS-48903 | SY049928 | UNII-I9H95PVI1P | AKOS015840462 | EINECS 221-196-6 | P |
|---|---|
| Specifications & Purity | ≥99% |
| Shipped In | Normal |
| Product Description |
1-Pyrenecarboxaldehyde is a novel base-discriminating fluorescent (BDF) compound and a highly polarity-sensitive fluorophore for SNP typing. |
Taxonomic Classification
Taxonomy Tree
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Kingdom
Organic compounds
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Superclass
Benzenoids
- Class Pyrenes
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Superclass
Benzenoids
| Kingdom | Organic compounds |
|---|---|
| Superclass | Benzenoids |
| Class | Pyrenes |
| Subclass | Not available |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Pyrenes |
| Alternative Parents | Phenanthrenes and derivatives Naphthalenes Aryl-aldehydes Organic oxides Hydrocarbon derivatives |
| Molecular Framework | Aromatic homopolycyclic compounds |
| Substituents | Pyrene - Phenanthrene - Naphthalene - Aryl-aldehyde - Organic oxygen compound - Organic oxide - Hydrocarbon derivative - Organooxygen compound - Aldehyde - Aromatic homopolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as pyrenes. These are compounds containing a pyrene moiety, which consists four fused benzene rings, resulting in a flat aromatic system. |
| External Descriptors | Not available |
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Names and Identifiers
| Pubchem Sid | 488188837 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488188837 |
| IUPAC Name | pyrene-1-carbaldehyde |
| INCHI | InChI=1S/C17H10O/c18-10-14-7-6-13-5-4-11-2-1-3-12-8-9-15(14)17(13)16(11)12/h1-10H |
| InChIKey | RCYFOPUXRMOLQM-UHFFFAOYSA-N |
| Smiles | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C=O |
| Isomeric SMILES | C1=CC2=C3C(=C1)C=CC4=C(C=CC(=C43)C=C2)C=O |
| WGK Germany | 3 |
| RTECS | UR2450200 |
| Molecular Weight | 230.26 |
| Beilstein | 1874889 |
| Reaxy-Rn | 1874889 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=1874889&ln= |
Certificates（CoA,COO,BSE/TSE and Analysis Chart)
C of A & Other Certificates(BSE/TSE, COO):
Analytical Chart:
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 L2206564 |
Certificate of Analysis | Feb 17, 2025 | P131479 |
| L2206549 |
Certificate of Analysis | Sep 18, 2024 | P131479 |
| L2206548 |
Certificate of Analysis | Sep 18, 2024 | P131479 |
| L2206586 |
Certificate of Analysis | Sep 18, 2024 | P131479 |
| L2206568 |
Certificate of Analysis | Sep 18, 2024 | P131479 |
| J2228140 |
Certificate of Analysis | Aug 12, 2024 | P131479 |
| H2401459 |
Certificate of Analysis | Jun 18, 2024 | P131479 |
| H2401461 |
Certificate of Analysis | Jun 18, 2024 | P131479 |
| H2401457 |
Certificate of Analysis | Jun 18, 2024 | P131479 |
| H2401458 |
Certificate of Analysis | Jun 18, 2024 | P131479 |
| H2401460 |
Certificate of Analysis | Jun 18, 2024 | P131479 |
| A2411732 |
Certificate of Analysis | Oct 26, 2023 | P131479 |
| A2411733 |
Certificate of Analysis | Oct 26, 2023 | P131479 |
| A2411734 |
Certificate of Analysis | Oct 26, 2023 | P131479 |
| A2411731 |
Certificate of Analysis | Oct 26, 2023 | P131479 |
| H2109336 |
Certificate of Analysis | May 11, 2023 | P131479 |
| D1909139 |
Certificate of Analysis | Dec 08, 2022 | P131479 |
| A2118080 |
Certificate of Analysis | Nov 15, 2022 | P131479 |
| E1726022 |
Certificate of Analysis | Nov 11, 2022 | P131479 |
| C1826163 |
Certificate of Analysis | Jan 25, 2022 | P131479 |
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Chemical and Physical Properties
| Sensitivity | Light sensitive |
|---|---|
| Melt Point(°C) | 128 °C |
| Molecular Weight | 230.260 g/mol |
| XLogP3 | 4.500 |
| Hydrogen Bond Donor Count | 0 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 230.073 Da |
| Monoisotopic Mass | 230.073 Da |
| Topological Polar Surface Area | 17.100 Ų |
| Heavy Atom Count | 18 |
| Formal Charge | 0 |
| Complexity | 337.000 |
| 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 |
Citations of This Product
| 1. Peng Wang, Zhuochao Wang, Lu Liu, Guobing Ying, Wenxin Cao, Jiaqi Zhu. (2023) Self-Healable and Reprocessable Silicon Elastomers Based on Imine–Boroxine Bonds for Flexible Strain Sensor. MOLECULES, 28 (16): (6049). |
| 2. Jiang Nan, Zhou Xue, Zhong Tianyuan, Wang Guang. (2023) A new pyrene-based “turn-on” fluorescent probe for highly selective detection of hypochlorite in aqueous solution and in living cells. CHEMICAL PAPERS, 77 (1): (197-205). |
| 3. Ban-Peng Cao, Changhao Dai, Xuejun Wang, Qiang Xiao, Dacheng Wei. (2022) Ultrasensitive and Regenerative Transistor Sensor Based on Dynamic Covalent Chemistry. SENSORS, 22 (18): (6947). |
| 4. Yaran Cheng, Jing Chen, Tong Wang, Qin Wu, Daxin Shi, Yaoyuan Zhang, Kangcheng Chen, Hansheng Li. (2023) Magnetically-separable acid-resistant CoFe2O4@Polymer@MIL-100 core-shell catalysts for the acetalization of benzaldehyde and methanol. JOURNAL OF COLLOID AND INTERFACE SCIENCE, 629 (571). |
| 5. Yujiao Wang, Qingyu Guo, Xingyi Wu, Haixiang Gao, Runhua Lu, Wenfeng Zhou. (2022) A facile and total water-soluble fluorescent organic nanoparticles-based sensor for Hg2+ detection and its application in tea samples. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 265 (120358). |
| 6. Yanqing Wang, Qianqian Han, Ying Wang, Dan Qin, Qiang Luo, Hongmei Zhang. (2020) Self-assembly, rheological properties and antioxidant activities of chitosan grafted with tryptophan and phenylalanine. COLLOIDS AND SURFACES A-PHYSICOCHEMICAL AND ENGINEERING ASPECTS, 597 (124763). |
| 7. Yilin Zhu, Kangnan Wang, Xiangwen Wu, Yanan Sun, Xiangshuo Gong, Duxia Cao, Ruifang Guan, Zhiqiang Liu. (2020) A highly sensitive turn-on fluorescent probe for real-time detecting hypochlorite and its application in living cells. TALANTA, 209 (120548). |
| 8. Yaqin Wu, Xiaoye Wen, Zhefeng Fan. (2019) An AIE active pyrene based fluorescent probe for selective sensing Hg2+ and imaging in live cells. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 223 (117315). |
| 9. Xiangxu Cui, Tingting Li, Jiashuang Li, Yukun An, Libao An, Xinmu Zhang, Zhiming Zhang. (2019) A highly selective and reversible turn-off fluorescent chemosensor for Cu2+ based on electrospun nanofibrous membrane modified with pyrenecarboxaldehyde. SPECTROCHIMICA ACTA PART A-MOLECULAR AND BIOMOLECULAR SPECTROSCOPY, 207 (173). |
| 10. Titao Jing, Ziye Wu, Zheng Ruan, Tuanwei Li, Jun Jiang, Lifeng Yan. (2017) Intelligent Fluorescence Probe with Turn-on Properties By a “See-Saw” Balance of Visible and Near-infrared Fluorescence. ChemPhotoChem, 1 (12): (568-574). |
| 11. Feng Bai, Jiajing Diao, Ying Wang, Shixin Sun, Hongmei Zhang, Yunyun Liu, Yanqing Wang, Jian Cao. (2017) A New Water-Soluble Nanomicelle Formed through Self-Assembly of Pectin–Curcumin Conjugates: Preparation, Characterization, and Anticancer Activity Evaluation. JOURNAL OF AGRICULTURAL AND FOOD CHEMISTRY, 65 (32): (6840–6847). |
| 12. Nan Li, Li Qi, Juan Qiao, Yi Chen. (2016) Ratiometric Fluorescent Pattern for Sensing Proteins Using Aqueous Polymer-Pyrene/γ-Cyclodextrin Inclusion Complexes. ANALYTICAL CHEMISTRY, 88 (3): (1821–1826). |
| 13. Jing Liang, Yu Ya, Dejiao Ning, Cuiwen Jiang, Yanli Wang, Liping Xie, Xiaochuan Huang, Tao Li, Li Tang, Feiyan Yan. (2024) A pyrene based “turn-on” fluorescent sensor for highly sensitive detection of Cu2+ and 3-nitropropionic acid. JOURNAL OF FOOD COMPOSITION AND ANALYSIS, 130 (106174). |
| 14. Jiajing Zhang, Yaqin Han, Junan Fang, Jia An, Jincai Peng, Xiaohui Zhu, Yufei Liu. (2025) Achieving precise luminescence regulation through manipulating aggregation and protonation in pyrene-based materials. CHEMICAL ENGINEERING JOURNAL, 503 (158623). |
| 15. Dandan Lu, Jie Zhang, Mingzhi Deng, Xiaoqian Liu, Ziyao Liu, Keyang Yin, Hongguang Li. (2024) Impressive nonlinear optical response of π-conjugated, photoluminescent soft nanoparticles in polymer matrix. CARBON, 230 (119607). |
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