DL-3-Phenyllactic acid


Chemical Name: DL-3-Phenyllactic acid
CAS Number: 828-01-3
Product Number: AG004TF2(AGN-PC-0WAFZF)
Synonyms:
MDL No:
Molecular Formula: C9H10O3
Molecular Weight: 166.1739

Identification/Properties


Properties
MP:
95-98 °C
BP:
1399.4°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.5286 (estimate)
Computed Properties
Molecular Weight:
166.176g/mol
XLogP3:
1.1
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
166.063g/mol
Monoisotopic Mass:
166.063g/mol
Topological Polar Surface Area:
57.5A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
150
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#:
-
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P280-P301+P312-P302+P352-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



2-Hydroxy-3-phenylpropanoic acid, also known as mandelic acid, is a versatile compound widely used in chemical synthesis. Its applications range across various fields due to its unique properties and reactivity. In organic chemistry, mandelic acid serves as a chiral building block in the synthesis of pharmaceuticals, agrochemicals, and fragrances. Its chirality allows for the creation of enantiopure compounds, crucial in the development of drugs and biologically active molecules. Additionally, mandelic acid can undergo various chemical reactions, such as esterification and reduction, making it a valuable intermediate in the production of specialty chemicals. With its broad utility and practicality in organic synthesis, 2-Hydroxy-3-phenylpropanoic acid plays a pivotal role in advancing the field of chemistry.