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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, 3-bromo-4-methoxy-, ethyl ester

CCOC(=O)Cc1ccc(c(c1)Br)OC Request for Quotation
Chemical Name: Benzeneacetic acid, 3-bromo-4-methoxy-, ethyl ester
CAS Number: 100125-96-0
Product Number: AG00010M(AGN-PC-0BT1SY)
Synonyms:
MDL No:
Molecular Formula: C11H13BrO3
Molecular Weight: 273.1231

Identification/Properties

Computed Properties
Molecular Weight:
273.126g/mol
XLogP3:
2.7
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
5
Exact Mass:
272.005g/mol
Monoisotopic Mass:
272.005g/mol
Topological Polar Surface Area:
35.5A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
208
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


Ethyl 2-(3-bromo-4-methoxyphenyl)acetate is a versatile compound widely utilized in organic synthesis due to its reactivity and functional group compatibility. One common application of this compound is as a key intermediate in the synthesis of pharmaceuticals and agrochemicals. Its unique structure allows for selective functionalization at the bromo and methoxy positions, enabling the formation of complex molecular structures with high precision. Additionally, the ethyl ester group offers opportunities for further derivatization, making it a valuable building block in the production of fine chemicals. The use of Ethyl 2-(3-bromo-4-methoxyphenyl)acetate in chemical synthesis demonstrates its significance in facilitating the development of innovative and efficient synthetic routes towards various biologically active compounds.