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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)-

Boronic acid,B-[3-bromo-5-(1-methylethoxy)phenyl]-

CC(Oc1cc(cc(c1)Br)B(O)O)C Request for Quotation
Chemical Name: Boronic acid,B-[3-bromo-5-(1-methylethoxy)phenyl]-
CAS Number: 871125-81-4
Product Number: AG003J2Z(AGN-PC-0VAUES)
Synonyms:
MDL No:
Molecular Formula: C9H12BBrO3
Molecular Weight: 258.9048

Identification/Properties

Properties
MP:
140-145°C
BP:
377.9°C at 760 mmHg
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
258.906g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
3
Exact Mass:
258.006g/mol
Monoisotopic Mass:
258.006g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
177
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#:
-
Hazard Statements:
H315
Precautionary Statements:
P280
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


The (3-Bromo-5-isopropoxyphenyl)boronic acid is a versatile chemical compound known for its significant utility in the field of chemical synthesis. As a boronic acid derivative, it serves as a valuable building block in the creation of various organic molecules through Suzuki-Miyaura cross-coupling reactions. This compound is particularly useful in the development of pharmaceuticals, agrochemicals, and materials science. Its unique structure enables it to participate in key bond-forming processes, leading to the construction of complex molecular structures. Additionally, the (3-Bromo-5-isopropoxyphenyl)boronic acid's stability and reactivity make it an essential reagent in modern synthetic organic chemistry, facilitating the efficient synthesis of diverse compounds with high precision and control.