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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)-

Benzoic acid, 4-acetyl-, ethyl ester

CCOC(=O)c1ccc(cc1)C(=O)C Request for Quotation
Chemical Name: Benzoic acid, 4-acetyl-, ethyl ester
CAS Number: 38430-55-6
Product Number: AG003Q9N(AGN-PC-0JTL83)
Synonyms:
MDL No: MFCD00013241
Molecular Formula: C11H12O3
Molecular Weight: 192.2112

Identification/Properties

Properties
MP:
55-57 °C(lit.);
BP:
310°C at 760 mmHg
Storage:
Inert atmosphere;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
192.214g/mol
XLogP3:
1.9
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
192.079g/mol
Monoisotopic Mass:
192.079g/mol
Topological Polar Surface Area:
43.4A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
215
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

NMR Spectrum

Other Analytical Data

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Chemical Structure


Ethyl 4-acetylbenzoate, also known as ethyl 4-acetoxybenzoate, is a versatile compound widely utilized in chemical synthesis for its unique properties and reactions. In the realm of organic chemistry, this compound serves as a key intermediate in the synthesis of various pharmaceuticals, agrochemicals, and fragrances due to its ability to undergo a range of chemical transformations.One of the notable applications of ethyl 4-acetylbenzoate is its involvement in the preparation of heterocyclic compounds such as benzimidazoles and benzothiazoles. These heterocycles are crucial structural motifs found in many biologically active compounds, making ethyl 4-acetylbenzoate a valuable precursor in medicinal chemistry research.Furthermore, ethyl 4-acetylbenzoate can participate in the synthesis of aromatic ketones, acyl derivatives, and esters through various reactions such as Friedel-Crafts acylation, Knoevenagel condensation, and Claisen condensation. These synthetic pathways enable the functionalization of the benzene ring and the introduction of new chemical groups, expanding the potential applications of the final products.Overall, the strategic placement of the acetyl group in ethyl 4-acetylbenzoate confers chemical reactivity that can be harnessed for the efficient synthesis of diverse organic molecules with tailored properties and functionalities.