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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-[(acetyloxy)methyl]-

CC(=O)OCc1ccc(cc1)C(=O)O Request for Quotation
Chemical Name: Benzoic acid, 4-[(acetyloxy)methyl]-
CAS Number: 15561-46-3
Product Number: AG001O2B(AGN-PC-0LW9H5)
Synonyms:
MDL No: MFCD01090957
Molecular Formula: C10H10O4
Molecular Weight: 194.1840

Identification/Properties

Properties
MP:
123-124℃
BP:
327.4°C at 760 mmHg
Storage:
Keep in dry area;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
194.186g/mol
XLogP3:
1.5
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
4
Exact Mass:
194.058g/mol
Monoisotopic Mass:
194.058g/mol
Topological Polar Surface Area:
63.6A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
216
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:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-(Acetoxymethyl)benzoic acid is a versatile compound widely utilized in chemical synthesis due to its unique reactivity and structural properties. As an ester derivative of benzoic acid, it serves as a valuable building block for the synthesis of various organic compounds. In chemical synthesis, 4-(Acetoxymethyl)benzoic acid can act as an acylating agent, enabling the introduction of an acetoxymethyl group onto different functional groups within a molecule. This acylation reaction can be used to modify the reactivity and properties of the parent compound, leading to the formation of new and complex chemical structures.Furthermore, 4-(Acetoxymethyl)benzoic acid is often employed in the preparation of pharmaceutical intermediates and fine chemicals. Its ability to undergo various transformations, such as hydrolysis, decarboxylation, and substitution reactions, makes it a crucial component in the synthesis of bioactive molecules and advanced materials.Overall, the application of 4-(Acetoxymethyl)benzoic acid in chemical synthesis showcases its significance in organic chemistry as a key reagent for the development of novel compounds with diverse functionalities and potential applications.