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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)-

3-Pyridinecarboxylicacid, 5-borono- (9CI)

OB(c1cncc(c1)C(=O)O)O Request for Quotation
Chemical Name: 3-Pyridinecarboxylicacid, 5-borono- (9CI)
CAS Number: 913836-03-0
Product Number: AG003MLH(AGN-PC-0KWHD2)
Synonyms:
MDL No: MFCD02323212
Molecular Formula: C6H6BNO4
Molecular Weight: 166.9271

Identification/Properties

Properties
MP:
226-230°C
BP:
486.3°C at 760 mmHg
Storage:
2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
166.927g/mol
Hydrogen Bond Donor Count:
3
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
167.039g/mol
Monoisotopic Mass:
167.039g/mol
Topological Polar Surface Area:
90.6A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
175
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-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


5-Borononicotinic acid is a versatile chemical compound commonly used in organic synthesis due to its unique properties and reactivity. This compound serves as a valuable building block in the preparation of various pharmaceuticals, agrochemicals, and materials. Its boron functionality allows for efficient cross-coupling reactions in transition metal-catalyzed processes, enabling the formation of carbon-carbon and carbon-heteroatom bonds. Additionally, 5-Borononicotinic acid can be utilized in Suzuki-Miyaura coupling reactions to introduce functional groups, such as aryl and vinyl moieties, into organic molecules. Furthermore, its presence in the molecular structure can enhance the stability and bioactivity of certain compounds, making it a valuable tool in drug discovery and development. Overall, the application of 5-Borononicotinic acid in chemical synthesis showcases its significance as a key intermediate in the preparation of diverse compounds with potential applications in various fields.