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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)-

Benzeneacetic acid, a-hydroxy-, monosodium salt

OC(c1ccccc1)C(=O)[O-].[Na+] Request for Quotation
Chemical Name: Benzeneacetic acid, a-hydroxy-, monosodium salt
CAS Number: 114-21-6
Product Number: AG000A9J(AGN-PC-0P5YVT)
Synonyms:
MDL No:
Molecular Formula: C8H7NaO3
Molecular Weight: 174.1292

Identification/Properties

Properties
BP:
321.8°C at 760 mmHg
Storage:
Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
174.131g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
2
Exact Mass:
174.029g/mol
Monoisotopic Mass:
174.029g/mol
Topological Polar Surface Area:
60.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
143
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:
2
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


Sodium DL-Mandelate, a versatile compound used in chemical synthesis, plays a crucial role in various industrial applications. This compound serves as a key reagent in the production of pharmaceuticals, agrochemicals, and specialty chemicals. Its multifunctional nature allows it to participate in a wide range of reactions, making it a valuable tool in organic synthesis.Furthermore, Sodium DL-Mandelate is frequently employed in the formation of chiral molecules due to its ability to act as a chiral auxiliary or ligand. This characteristic makes it particularly useful in asymmetric synthesis, where the creation of enantiomerically pure compounds is essential.In addition to its role in chiral chemistry, Sodium DL-Mandelate also serves as an intermediate in the synthesis of various chemicals, such as fragrances, flavorings, and polymer additives. Its versatility and compatibility with a variety of reaction conditions make it a popular choice among chemists and researchers seeking to develop innovative and efficient synthetic routes.Overall, Sodium DL-Mandelate's diverse applications and reliable performance make it a valuable asset in the field of chemical synthesis, enabling the creation of complex molecules with precision and efficiency.