Carbamic acid, [(2S)-2-amino-3-phenylpropyl]-, 1,1-dimethylethyl ester


Chemical Name: Carbamic acid, [(2S)-2-amino-3-phenylpropyl]-, 1,1-dimethylethyl ester
CAS Number: 167298-44-4
Product Number: AG001X92(AGN-PC-0O4QZ9)
Synonyms:
MDL No: MFCD11858348
Molecular Formula: C14H22N2O2
Molecular Weight: 250.3367

Identification/Properties


Properties
BP:
375.2°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
250.342g/mol
XLogP3:
2
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
6
Exact Mass:
250.168g/mol
Monoisotopic Mass:
250.168g/mol
Topological Polar Surface Area:
64.4A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
255
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#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



(S)-tert-Butyl (2-amino-3-phenylpropyl)carbamate is a versatile compound widely used in chemical synthesis due to its ability to serve as a chiral building block in various reactions. This compound plays a crucial role in asymmetric synthesis, allowing for the creation of optically pure molecules with defined stereochemistry.In the field of medicinal chemistry, (S)-tert-Butyl (2-amino-3-phenylpropyl)carbamate is utilized in the synthesis of pharmaceuticals and bioactive compounds. Its chiral nature enables the production of enantiomerically pure drug candidates, which are essential for optimizing therapeutic efficacy and minimizing side effects.Furthermore, this compound can be employed in the preparation of complex organic molecules, such as natural products and agrochemicals, where precise control over stereochemistry is paramount. By incorporating (S)-tert-Butyl (2-amino-3-phenylpropyl)carbamate into synthetic pathways, chemists can efficiently access a wide range of structurally diverse compounds with tailored properties.Overall, the application of (S)-tert-Butyl (2-amino-3-phenylpropyl)carbamate in chemical synthesis facilitates the construction of stereochemically pure molecules essential for advancing drug discovery, material science, and other areas of chemical research.