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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-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline

Cc1ccc(c(c1)B1OC(C(O1)(C)C)(C)C)N Request for Quotation
Chemical Name: 4-methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline
CAS Number: 948592-80-1
Product Number: AG005U8F(AGN-PC-01LR07)
Synonyms:
MDL No:
Molecular Formula: C13H20BNO2
Molecular Weight: 233.1144

Identification/Properties

Properties
MP:
82-85°C
BP:
355.7±35.0 °C(Predicted)
Storage:
Inert atmosphere;2-8℃;
Form:
Solid
Computed Properties
Molecular Weight:
233.118g/mol
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
3
Rotatable Bond Count:
1
Exact Mass:
233.159g/mol
Monoisotopic Mass:
233.159g/mol
Topological Polar Surface Area:
44.5A^2
Heavy Atom Count:
17
Formal Charge:
0
Complexity:
277
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:
H302
Precautionary Statements:
P280-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum

Other Analytical Data

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Chemical Structure


4-Methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline is a versatile compound utilized in chemical synthesis as a key intermediate in the formation of various organic molecules. This compound plays a crucial role in the preparation of pharmaceuticals, agrochemicals, and advanced materials due to its unique structural properties.In chemical synthesis, 4-Methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline serves as a building block for the synthesis of complex organic compounds. Its functional groups enable it to participate in a variety of chemical reactions, such as Suzuki coupling, Heck reaction, and Buchwald-Hartwig amination, allowing for the creation of diverse molecular structures.This compound is particularly valuable in the pharmaceutical industry, where it can be used to synthesize drug candidates and active pharmaceutical ingredients. Its ability to undergo selective functionalization and substitution reactions makes it a highly sought-after reagent in medicinal chemistry research.Additionally, in the field of materials science, 4-Methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline can be employed to fabricate functional materials with tailored properties, such as conducting polymers, liquid crystals, and optoelectronic components. Its incorporation into polymer chains enhances the performance and stability of the resulting materials.Overall, the significance of 4-Methyl-2-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)aniline in chemical synthesis lies in its versatility and utility as a strategic building block for the construction of various molecular frameworks with diverse applications.