Carbamic acid, (4-chloro-2-pyridinyl)-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, (4-chloro-2-pyridinyl)-, 1,1-dimethylethyl ester
CAS Number: 130721-78-7
Product Number: AG000UUT(AGN-PC-0K6AYW)
Synonyms:
MDL No:
Molecular Formula: C10H13ClN2O2
Molecular Weight: 228.6754

Identification/Properties


Computed Properties
Molecular Weight:
228.676g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
228.067g/mol
Monoisotopic Mass:
228.067g/mol
Topological Polar Surface Area:
51.2A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
228
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H317
Precautionary Statements:
P280
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



The tert-Butyl (4-chloropyridin-2-yl)carbamate is a versatile chemical compound that finds extensive application in chemical synthesis processes. This compound serves as a valuable building block in the creation of various organic molecules due to its unique structural features and reactivity profile.In chemical synthesis, tert-Butyl (4-chloropyridin-2-yl)carbamate is commonly employed as a protecting group for amines. By utilizing this compound as a protecting group, chemists can selectively shield the amine functional group in a molecule, allowing specific reactions to occur without undesired interactions with the amine group. This controlled protection and deprotection process plays a crucial role in the synthesis of complex organic molecules with multiple reactive sites.Additionally, tert-Butyl (4-chloropyridin-2-yl)carbamate can also serve as a precursor for the introduction of the pyridine ring system into target molecules. The 4-chloro substituent on the pyridine ring provides a handle for further functionalization, enabling the incorporation of diverse chemical functionalities into the final compound. This flexibility in structural modification makes tert-Butyl (4-chloropyridin-2-yl)carbamate a valuable tool for designing and synthesizing new chemical entities with tailored properties and activities.Overall, the application of tert-Butyl (4-chloropyridin-2-yl)carbamate in chemical synthesis represents a strategic approach to accessing complex organic molecules with precision and efficiency. Its role as a protecting group and precursor highlights its significance in the synthesis of pharmaceuticals, agrochemicals, and other fine chemicals.