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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-(ethoxymethyl)-

CCOCc1ccc(cc1)C(=O)O Request for Quotation
Chemical Name: Benzoic acid, 4-(ethoxymethyl)-
CAS Number: 146781-28-4
Product Number: AG001EBT(AGN-PC-0JOR1W)
Synonyms:
MDL No:
Molecular Formula: C10H12O3
Molecular Weight: 180.2005

Identification/Properties

Computed Properties
Molecular Weight:
180.203g/mol
XLogP3:
1.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
4
Exact Mass:
180.079g/mol
Monoisotopic Mass:
180.079g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
13
Formal Charge:
0
Complexity:
160
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
Precautionary Statements:
P280-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-(Ethoxymethyl)benzoic acid, also known as ethyl 4-formylbenzoate, is a versatile compound widely utilized in chemical synthesis. This compound serves as a key building block in the production of various pharmaceuticals, agrochemicals, and fine chemicals. Its unique structure containing both an ester group and a carboxylic acid group allows for diverse functionalization and reactivity in organic reactions.In chemical synthesis, 4-(Ethoxymethyl)benzoic acid can be used as a precursor for the synthesis of other aromatic compounds by undergoing various transformations such as reduction, oxidation, and substitution reactions. One common application is the conversion of this compound into different derivatives for the preparation of novel drugs or biologically active molecules. Additionally, it can participate in esterification reactions to form ester compounds with different alkyl chains, enhancing its application in the fragrance and flavor industries.Moreover, 4-(Ethoxymethyl)benzoic acid is a valuable starting material for the synthesis of liquid crystals, polymers, and functional materials due to its ability to introduce specific functional groups onto the benzene ring. Its versatility and reactivity make it a crucial intermediate in the development of advanced materials and compounds with tailored properties for various industrial applications.