Carbamic acid, (5-methyl-3-isoxazolyl)-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, (5-methyl-3-isoxazolyl)-, 1,1-dimethylethyl ester
CAS Number: 97517-66-3
Product Number: AG005ZAT(AGN-PC-0NF3F7)
Synonyms:
MDL No:
Molecular Formula: C9H14N2O3
Molecular Weight: 198.2191

Identification/Properties


Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
198.222g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
198.1g/mol
Monoisotopic Mass:
198.1g/mol
Topological Polar Surface Area:
64.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
213
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



The tert-Butyl (5-methylisoxazol-3-yl)carbamate is a valuable compound widely utilized in chemical synthesis. This versatile intermediate plays a crucial role in various reactions, serving as a key building block for the synthesis of diverse organic compounds. Its unique structure and reactivity make it a highly sought-after component in the production of pharmaceuticals, agrochemicals, and other fine chemicals. The tert-Butyl (5-methylisoxazol-3-yl)carbamate offers chemists a reliable and efficient tool for introducing specific functionalities into target molecules, enabling the creation of novel and complex compounds with tailored properties and applications in a range of industries.