o-Chlorobenzaldehyde has been used in generation of small focused library of diversely functionalized dihydropyrimidine derivatives via one-pot three-component Biginelli cyclocondensation of β-ketoesters, aldehydes and thioureas
This compound belongs to the class of organic compounds known as benzoyl derivatives. These are organic compounds containing an acyl moiety of benzoic acid with the formula (C6H5CO-).
External Descriptors
Not available
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61.
Soluble in water (1.8g/L), alcohol, ether, benzene, and acetone.
Sensitivity
light sensitive, air sensitive,Moisture sensitive
Freezing Point(°C)
9 °C
Refractive Index
1.5662
Flash Point(°F)
87℃
Flash Point(°C)
87℃
Boil Point(°C)
213-214°C
Melt Point(°C)
11°C
Molecular Weight
140.560 g/mol
XLogP3
2.300
Hydrogen Bond Donor Count
0
Hydrogen Bond Acceptor Count
1
Rotatable Bond Count
1
Exact Mass
140.003 Da
Monoisotopic Mass
140.003 Da
Topological Polar Surface Area
17.100 Ų
Heavy Atom Count
9
Formal Charge
0
Complexity
103.000
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
References
1.Haiwen Li, Junhu Xin, Yuhang Xue, Cunde Wang. (2022) DBU-Mediated Domino Annulation Reaction of 2-Amino-4H-chromen-4-ones and Aromatic Aldehydes for Synthesis of Polysubstituted 3-Hydroxy-5H-chromeno[2,3-b]pyridinones. JOURNAL OF ORGANIC CHEMISTRY, [PMID:35960790][10.1021/acs.joc.2c01152]
2.Ouyang Xiaoyan, Fan Yunyan, Huang Shan, Liu Xiaoling. (2022) Rapid and accurate quantification and analysis of nitrofuran metabolites residues in aquatic products by ultra-high performance liquid chromatography–tandem mass spectrometry. EUROPEAN FOOD RESEARCH AND TECHNOLOGY, 248 (11):(2857-2864). [PMID:][10.1007/s00217-022-04095-8]
3.Yawen Rong, Md Mehedi Hassan, Qin Ouyang, Li Wang, Tianhui Jiao, Quansheng Chen. (2021) Ratiometric upconversion fluorometric turn-off nanosensor for quantification of furfural in foods. SENSORS AND ACTUATORS B-CHEMICAL, [PMID:][10.1016/j.snb.2021.130843]
4.Zhu Anlian, Li Qixing, Feng Wanlu, Fan Dongshuang, Li Lingjun. (2020) Biocompatible Ionic Liquid Promote One-Pot Synthesis of 2-Amino-4H-Chromenes Under Ambient Conditions. CATALYSIS LETTERS, 151 (3):(720-733). [PMID:][10.1007/s10562-020-03332-7]
5.Xiaoyu Jiang, Lifen Xiao, Xinping Ai, Hanxi Yang, Yuliang Cao. (2017) A novel bifunctional thermo-sensitive poly(lactic acid)@poly(butylene succinate) core–shell fibrous separator prepared by a coaxial electrospinning route for safe lithium-ion batteries. Journal of Materials Chemistry A, 5 (44):(23238-23242). [PMID:][10.1039/C7TA08063H]
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K2226407