1-Piperazinecarboxylic acid, 2,6-dimethyl-, 1,1-dimethylethyl ester,(2R,6S)-rel-


Chemical Name: 1-Piperazinecarboxylic acid, 2,6-dimethyl-, 1,1-dimethylethyl ester,(2R,6S)-rel-
CAS Number: 180975-66-0
Product Number: AG0022I5(AGN-PC-0QBWSW)
Synonyms:
MDL No:
Molecular Formula: C11H22N2O2
Molecular Weight: 214.3046

Identification/Properties


Computed Properties
Molecular Weight:
214.309g/mol
XLogP3:
1.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
214.168g/mol
Monoisotopic Mass:
214.168g/mol
Topological Polar Surface Area:
41.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
225
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
2
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



A versatile building block in organic chemistry, (2R,6S)-rel-tert-Butyl 2,6-dimethylpiperazine-1-carboxylate serves as a crucial intermediate in chemical synthesis processes. With its unique stereochemistry and functional groups, this compound plays a significant role in the creation of various pharmaceuticals, agrochemicals, and specialty chemicals. Its presence enables the selective formation of complex molecular structures, making it a valuable tool for chemists engaged in the development of novel compounds for a range of applications. Furthermore, the (2R,6S)-rel-tert-Butyl 2,6-dimethylpiperazine-1-carboxylate's reactivity and stability make it a preferred choice in the realm of organic synthesis, contributing to the advancement of scientific research and innovation in the field.