(3S)-3-amino-3-thiophen-2-ylpropanoic acid


Chemical Name: (3S)-3-amino-3-thiophen-2-ylpropanoic acid
CAS Number: 18389-46-3
Product Number: AG0033KW(AGN-PC-0JLWDM)
Synonyms:
MDL No: MFCD00152178
Molecular Formula: C7H9NO2S
Molecular Weight: 171.2169

Identification/Properties


Properties
BP:
327.6°C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
171.214g/mol
XLogP3:
-2.3
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
171.035g/mol
Monoisotopic Mass:
171.035g/mol
Topological Polar Surface Area:
91.6A^2
Heavy Atom Count:
11
Formal Charge:
0
Complexity:
151
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

Safety Information


GHS Pictogram:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Thiophenepropanoic acid, β-amino- is a versatile chemical compound widely utilized in chemical synthesis for the creation of various pharmaceuticals, agrochemicals, and materials. This compound plays a crucial role in the development of novel drugs and materials due to its unique structural properties and reactivity. In organic synthesis, 2-Thiophenepropanoic acid, β-amino- serves as a key intermediate in the preparation of biologically active molecules and complex organic frameworks. Its functional groups allow for efficient manipulation during reactions, enabling the introduction of diverse substituents for fine-tuning the desired properties of the final products. Additionally, this compound exhibits excellent compatibility with a wide range of reagents and reaction conditions, making it a valuable building block in the synthesis of diverse chemical compounds. Its ability to undergo various transformations, such as nucleophilic substitutions, condensations, and cyclizations, makes it a crucial component in the development of innovative molecules with potential applications in pharmaceuticals, agriculture, and materials science.