Cas no 533885-39-1 (2-(methoxymethyl)-4,5-dimethyl-Thiazole)
533885-39-1 structure
Product Name:2-(methoxymethyl)-4,5-dimethyl-Thiazole
CAS No:533885-39-1
MF:C7H11NOS
MW:157.233340501785
CID:938420
PubChem ID:45121866
Update Time:2025-04-19
2-(methoxymethyl)-4,5-dimethyl-Thiazole Chemical and Physical Properties
Names and Identifiers
-
- 2-(methoxymethyl)-4,5-dimethyl-Thiazole
- 2-(methoxymethyl)-4,5-dimethylThiazole
- Thiazole, 2-(methoxymethyl)-4,5-dimethyl-
- 533885-39-1
- DA-27660
- SCHEMBL19002526
- 2-(Methoxymethyl)-4,5-dimethyl-1,3-thiazole
-
- Inchi： 1S/C7H11NOS/c1-5-6(2)10-7(8-5)4-9-3/h4H2,1-3H3
- InChI Key： UBAALENTBDXNML-UHFFFAOYSA-N
- SMILES： S1C(COC)=NC(C)=C1C
Computed Properties
- Exact Mass: 157.05613515g/mol
- Monoisotopic Mass: 157.05613515g/mol
- Isotope Atom Count: 0
- Hydrogen Bond Donor Count: 0
- Hydrogen Bond Acceptor Count: 3
- Heavy Atom Count: 10
- Rotatable Bond Count: 2
- Complexity: 110
- Covalently-Bonded Unit Count: 1
- Defined Atom Stereocenter Count: 0
- Undefined Atom Stereocenter Count : 0
- Defined Bond Stereocenter Count: 0
- Undefined Bond Stereocenter Count: 0
- XLogP3: 1.4
- Topological Polar Surface Area: 50.4?2
2-(methoxymethyl)-4,5-dimethyl-Thiazole Related Literature
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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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Marcin Czapla,Jack Simons Phys. Chem. Chem. Phys., 2018,20, 21739-21745
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Gloria Belén Ramírez-Rodríguez,José Manuel Delgado-López,Jaime Gómez-Morales CrystEngComm, 2013,15, 2206-2212
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Hanie Hashtroudi,Ian D. R. Mackinnon J. Mater. Chem. C, 2020,8, 13108-13126
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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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