Cas no 334017-25-3 (Ethyl 2-ethyl-5-methylthiazole-4-carboxylate)
334017-25-3 structure
Product Name:Ethyl 2-ethyl-5-methylthiazole-4-carboxylate
CAS No:334017-25-3
MF:C9H13NO2S
MW:199.27002120018
CID:917927
Update Time:2023-08-02
Ethyl 2-ethyl-5-methylthiazole-4-carboxylate Chemical and Physical Properties
Names and Identifiers
-
- 4-Thiazolecarboxylicacid,2-ethyl-5-methyl-,ethylester(9CI)
- ethyl 2-ethyl-5-methyl-1,3-thiazole-4-carboxylate
- 4-THIAZOLECARBOXYLIC ACID,2-ETHYL-5-METHYL-,ETHYL ESTER
- WGSHONKFRBXBMO-UHFFFAOYSA-N
- AB63607
- ETHYL 2-ETHYL-5-METHYLTHIAZOLE-4-CARBOXYLATE
- Ethyl 2-ethyl-5-methylthiazole-4-carboxylate
-
- Inchi： 1S/C9H13NO2S/c1-4-7-10-8(6(3)13-7)9(11)12-5-2/h4-5H2,1-3H3
- InChI Key： WGSHONKFRBXBMO-UHFFFAOYSA-N
- SMILES： S1C(C)=C(C(=O)OCC)N=C1CC
Computed Properties
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 4
- Heavy Atom Count: 13
- Rotatable Bond Count: 4
- Complexity: 187
- Topological Polar Surface Area: 67.4
Ethyl 2-ethyl-5-methylthiazole-4-carboxylate Related Literature
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Alexandre Vimont,Arnaud Travert,Philippe Bazin,Jean-Claude Lavalley,Marco Daturi,Christian Serre,Gérard Férey,Sandrine Bourrelly,Philip L. Llewellyn Chem. Commun., 2007, 3291-3293
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Ziyang Deng,Changwei Chen,Sunliang Cui RSC Adv., 2016,6, 93753-93755
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Shun-Ze Zhan,Mian Li,Xiao-Ping Zhou,Dan Li,Seik Weng Ng RSC Adv., 2011,1, 1457-1459
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Olga Guselnikova,Gérard Audran,Jean-Patrick Joly,Andrii Trelin,Evgeny V. Tretyakov,Vaclav Svorcik,Oleksiy Lyutakov,Sylvain R. A. Marque Chem. Sci., 2021,12, 4154-4161
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