19785-88-7 Purity
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Specification
The molecular formula of 3-Methyl-2-oxazolidone is C4H7NO2.
The molecular weight of 3-Methyl-2-oxazolidone is 101.10 g/mol.
The IUPAC name of 3-Methyl-2-oxazolidone is 3-methyl-1,3-oxazolidin-2-one.
The InChIKey of 3-Methyl-2-oxazolidone is VWIIJDNADIEEDB-UHFFFAOYSA-N.
3-Methyl-2-oxazolidone has 2 hydrogen bond acceptor counts.
The XLogP3-AA value of 3-Methyl-2-oxazolidone is -0.1.
The formal charge of 3-Methyl-2-oxazolidone is 0.
3-Methyl-2-oxazolidone has 0 rotatable bond counts.
Yes, 3-Methyl-2-oxazolidone is a canonicalized compound.
The topological polar surface area of 3-Methyl-2-oxazolidone is 29.5 Ų.
Reference: [1]Fischer
[Journal of the Chemical Society, 1952, p. 4525][Journal of the Chemical Society, 1953, p. 2836]
Reference: [1]Viard; Piganiol
[1950, p. 233,237]
Reference: [1]Viard; Piganiol
[Chim. et Ind. Sonderband 23. Congr. int. Chim. ind. Mailand 1950 S. 233, 238]
[2]Aeschlimann
[Festschr. E. Barell
Reference: [1] Tetrahedron Letters, 2009, vol. 50, # 34, p. 4857 - 4858
* For details of the synthesis route, please refer to the original source to ensure accuracy.