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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)-

[4-(2-nitroethyl)phenyl]boronic acid

OB(c1ccc(cc1)CC[N+](=O)[O-])O Request for Quotation
Chemical Name: [4-(2-nitroethyl)phenyl]boronic acid
CAS Number: 957034-36-5
Product Number: AG003BTZ(AGN-PC-0713DP)
Synonyms:
MDL No:
Molecular Formula: C8H10BNO4
Molecular Weight: 194.9803

Identification/Properties

Properties
Storage:
Keep in dry area;2-8℃;
Computed Properties
Molecular Weight:
194.981g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
195.07g/mol
Monoisotopic Mass:
195.07g/mol
Topological Polar Surface Area:
86.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
186
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


The compound (4-(2-Nitroethyl)phenyl)boronic acid, also known as $name$, is a versatile chemical reagent widely used in organic synthesis. Its unique structure containing both a boronic acid and a nitro group confers distinctive properties that make it valuable in various chemical transformations.One of the key applications of (4-(2-Nitroethyl)phenyl)boronic acid in chemical synthesis is as a building block for the synthesis of complex organic molecules. The boronic acid moiety in the compound is highly reactive towards Suzuki-Miyaura cross-coupling reactions, enabling the formation of C-C bonds with aryl halides or pseudohalides. This reaction is widely utilized in the synthesis of pharmaceuticals, agrochemicals, and materials.Additionally, the nitro group in (4-(2-Nitroethyl)phenyl)boronic acid can undergo reduction to the corresponding amine, providing a useful handle for further functionalization or structural modifications. This versatility allows for the introduction of additional functional groups or stereocenters, expanding the chemical diversity and potential applications of the synthesized compounds.Overall, the strategic incorporation of (4-(2-Nitroethyl)phenyl)boronic acid in chemical synthesis offers synthetic chemists a powerful tool for the construction of complex molecules with precise control over regioselectivity, stereoselectivity, and functional group compatibility.