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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, 3-(bromoacetyl)-

BrCC(=O)c1cccc(c1)C(=O)O Request for Quotation
Chemical Name: Benzoic acid, 3-(bromoacetyl)-
CAS Number: 62423-73-8
Product Number: AG00EB8B(AGN-PC-0KKLBL)
Synonyms:
MDL No:
Molecular Formula: C9H7BrO3
Molecular Weight: 243.0541

Identification/Properties

Properties
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
243.056g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
241.958g/mol
Monoisotopic Mass:
241.958g/mol
Topological Polar Surface Area:
54.4A^2
Heavy Atom Count:
13
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

GHS Pictogram:
Signal Word:
Danger
UN#:
1759
Hazard Statements:
H314
Precautionary Statements:
P260-P264-P280-P301+P330+P331-P303+P361+P353-P304+P340-P305+P351+P338-P310-P321-P363-P405-P501
Class:
8
Packing Group:
Ⅲ

NMR Spectrum

Other Analytical Data

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Chemical Structure


3-(2-Bromoacetyl)benzoic acid is a versatile compound widely used in chemical synthesis due to its unique reactivity and functional groups. This compound serves as a valuable building block for the synthesis of various organic molecules, particularly in the field of medicinal chemistry and drug development.One key application of 3-(2-Bromoacetyl)benzoic acid lies in its ability to undergo nucleophilic substitution reactions, wherein the bromoacetyl group can be easily substituted with different nucleophiles to introduce diverse functional groups. This reactivity makes it an essential precursor for the synthesis of complex organic compounds with tailored properties.Additionally, the benzoic acid moiety in 3-(2-Bromoacetyl)benzoic acid can participate in aromatic substitution reactions, enabling further functionalization of the molecule. By leveraging these reactivity patterns, chemists can design and synthesize novel molecules with specific pharmacological, biological, or material properties.Overall, 3-(2-Bromoacetyl)benzoic acid plays a crucial role in the realm of chemical synthesis, offering a robust platform for the development of new compounds with potential applications in various scientific disciplines.