3-AMino-azepane-1-carboxylic acid tert-butyl ester


Chemical Name: 3-AMino-azepane-1-carboxylic acid tert-butyl ester
CAS Number: 1032684-85-7
Product Number: AG0032EJ(AGN-PC-0WA82N)
Synonyms:
MDL No: MFCD11041391
Molecular Formula: C11H22N2O2
Molecular Weight: 214.3046

Identification/Properties


Properties
BP:
296.5±33.0°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Liquid
Computed Properties
Molecular Weight:
214.309g/mol
XLogP3:
1.1
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:
55.6A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
223
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
1
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:
P264-P280-P302+P352-P337+P313-P305+P351+P338-P362+P364-P332+P313
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



The (R)-tert-butyl 3-aminoazepane-1-carboxylate, a versatile compound often utilized in chemical synthesis, serves as an essential building block in the creation of various pharmaceuticals, agrochemicals, and fine chemicals. With its unique structural properties, this compound plays a crucial role in the formation of complex molecular structures, enabling chemists to develop novel compounds with diverse applications in the field of organic chemistry. By incorporating (R)-tert-butyl 3-aminoazepane-1-carboxylate into synthetic pathways, researchers can access a wide range of functional groups and stereochemical arrangements, facilitating the efficient production of target molecules with high purity and specificity. Its strategic incorporation in chemical synthesis processes not only enhances the efficiency of reactions but also allows for the development of innovative synthetic strategies, leading to the discovery of new molecules with potential therapeutic and industrial applications.