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Brc1cnc(nc1)C
Pyrimidine, 5-bromo-2-methyl-
CCCP1(=O)OP(=O)(CCC)OP(=O)(O1)CCC
1,3,5,2,4,6-Trioxatriphosphorinane, 2,4,6-tripropyl-, 2,4,6-trioxide
CC1(C)OB(OC1(C)C)B1OC(C(O1)(C)C)(C)C
2,2'-Bi-1,3,2-dioxaborolane, 4,4,4',4',5,5,5',5'-octamethyl-
O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.O=C(C=Cc1ccccc1)C=Cc1ccccc1.[Pd].[Pd]
Tris(dibenzylideneacetone)dipalladium
C1CCC(CC1)P(C1CCCCC1)C1CCCCC1.Cc1cc(C)c(c(c1)C)N1CCN(C1=[Ru](=Cc1ccccc1)(Cl)Cl)c1c(C)cc(cc1C)C
Ruthenium,[1,3-bis(2,4,6-trimethylphenyl)-2-imidazolidinylidene]dichloro(phenylmethylene)(tricyclohexylphosphine)-, (SP-5-41)-

3-Hydroxy-2-phenylpropionic Acid

OCC(c1ccccc1)C(=O)O Request for Quotation
Chemical Name: 3-Hydroxy-2-phenylpropionic Acid
CAS Number: 552-63-6
Product Number: AG00D8S4(AGN-PC-0WA8ON)
Synonyms:
MDL No:
Molecular Formula: C9H10O3
Molecular Weight: 166.1739

Identification/Properties

Properties
MP:
116-118 °C(lit.)
BP:
322.5°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Solubility:
methanol: 0.1 g/mL, clear
Computed Properties
Molecular Weight:
166.176g/mol
XLogP3:
0.8
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:
H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


3-Hydroxy-2-phenylpropanoic acid, also known as mandelic acid, is a versatile compound commonly utilized in various chemical synthesis processes. One of its key applications lies in the field of organic chemistry as a chiral building block. Due to its unique structure and properties, 3-Hydroxy-2-phenylpropanoic acid serves as a valuable precursor in the synthesis of pharmaceuticals, agrochemicals, and fine chemicals.In chemical synthesis, mandelic acid plays a crucial role as a starting material for the production of various optically active compounds. Its chiral nature enables the formation of enantiopure products, which are essential in medicinal chemistry for developing drugs with specific biological activities. By incorporating 3-Hydroxy-2-phenylpropanoic acid into synthetic routes, chemists can access a wide range of enantiomerically pure substances, thereby expanding the possibilities for creating new molecules with desired properties.Furthermore, mandelic acid can participate in diverse transformation reactions, such as esterification, amidation, and oxidation, to yield structurally complex molecules. Its compatibility with different functional groups makes it a valuable intermediate in the synthesis of complex fine chemicals and natural products. By harnessing the reactivity of 3-Hydroxy-2-phenylpropanoic acid, chemists can construct intricate molecular frameworks efficiently and selectively, paving the way for innovative discoveries in the realm of chemical synthesis.