tert-Butyl 6-amino-3,3a,6,6a-tetrahydrocyclopenta[c]pyrrole-2(1H)-carboxylate


Chemical Name: tert-Butyl 6-amino-3,3a,6,6a-tetrahydrocyclopenta[c]pyrrole-2(1H)-carboxylate
CAS Number: 1187930-92-2
Product Number: AG008ROW(AGN-PC-0WAGR3)
Synonyms:
MDL No:
Molecular Formula: C12H22N2O2
Molecular Weight: 226.3153

Identification/Properties


Computed Properties
Molecular Weight:
226.32g/mol
XLogP3:
1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
226.168128g/mol
Monoisotopic Mass:
226.168128g/mol
Topological Polar Surface Area:
55.6Ų
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
285
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
3
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
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



$tname$ is a versatile compound widely used in chemical synthesis due to its unique structural properties. It serves as a valuable building block in the creation of various organic molecules, particularly in the formation of complex pharmaceuticals, agrochemicals, and materials. With its cyclopentapyrrole core and amino acid ester functionality, $tname$ plays a crucial role in the construction of diverse molecular frameworks through efficient and selective synthetic routes. Whether employed as a key intermediate or as a core structural element, $tname$ offers chemists a powerful tool for the precise assembly of molecular structures with defined stereochemistry and functional group arrangements.