tert-butyl 4-amino-3,4-dihydro-2H-quinoline-1-carboxylate


Chemical Name: tert-butyl 4-amino-3,4-dihydro-2H-quinoline-1-carboxylate
CAS Number: 944906-95-0
Product Number: AG00IIAJ(AGN-PC-01UKBK)
Synonyms:
MDL No:
Molecular Formula: C14H20N2O2
Molecular Weight: 248.3208

Identification/Properties


Computed Properties
Molecular Weight:
248.326g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
248.152g/mol
Monoisotopic Mass:
248.152g/mol
Topological Polar Surface Area:
55.6A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
311
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
1
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

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Chemical Structure



The tert-Butyl 4-amino-3,4-dihydroquinoline-1(2H)-carboxylate is a versatile compound widely used in chemical synthesis as a key building block in the creation of various organic molecules and pharmaceuticals. Its unique chemical structure provides a valuable platform for the development of novel compounds with diverse applications in medicinal chemistry, materials science, and more. As a reagent in organic synthesis, tert-Butyl 4-amino-3,4-dihydroquinoline-1(2H)-carboxylate enables the efficient construction of complex molecules through key functional group transformations, such as amidation, alkylation, and cyclization reactions. This compound's strategic placement of the tert-butyl and amino groups offers enhanced control over regioselectivity and stereochemistry in synthetic pathways, making it a valuable tool for chemists seeking to access structurally diverse and biologically active compounds.