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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)-

α-Phenyl-o-toluic acid

OC(=O)c1ccccc1Cc1ccccc1 Request for Quotation
Chemical Name: α-Phenyl-o-toluic acid
CAS Number: 612-35-1
Product Number: AG003VG5(AGN-PC-0WAFXV)
Synonyms:
MDL No:
Molecular Formula: C14H12O2
Molecular Weight: 212.2439

Identification/Properties

Properties
MP:
112-115 °C(lit.)
BP:
363.2°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Refractive Index:
1.6000 (estimate)
Computed Properties
Molecular Weight:
212.248g/mol
XLogP3:
2.3
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
2
Rotatable Bond Count:
3
Exact Mass:
212.084g/mol
Monoisotopic Mass:
212.084g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
16
Formal Charge:
0
Complexity:
231
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
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


α-Phenyl-o-toluic acid is a versatile compound widely used in chemical synthesis. Its application in organic chemistry extends to various reactions where it acts as a key intermediate or starting material. This compound exhibits great potential in the synthesis of pharmaceuticals, agrochemicals, and specialty chemicals due to its unique chemical properties. With its aromatic phenyl and toluene moieties, α-Phenyl-o-toluic acid serves as a crucial building block for the construction of complex organic molecules. It can participate in reactions such as acylation, alkylation, and oxidation to yield diverse products with enhanced functionalities. Additionally, α-Phenyl-o-toluic acid can be utilized in the preparation of advanced materials such as polymers, dyes, and fine chemicals, further expanding its utility in the field of chemical synthesis.