1H-Indole-1-carboxylic acid, borono-, 1-(1,1-dimethylethyl) ester


Chemical Name: 1H-Indole-1-carboxylic acid, borono-, 1-(1,1-dimethylethyl) ester
CAS Number: 213318-44-6
Product Number: AG0035D0(AGN-PC-0KKVC4)
Synonyms:
MDL No: MFCD02093045
Molecular Formula: C13H16BNO4
Molecular Weight: 261.0814

Identification/Properties


Properties
MP:
100 °C
BP:
443.5°C at 760 mmHg
Storage:
Inert atmosphere;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
261.084g/mol
Hydrogen Bond Donor Count:
2
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
261.117g/mol
Monoisotopic Mass:
261.117g/mol
Topological Polar Surface Area:
71.7A^2
Heavy Atom Count:
19
Formal Charge:
0
Complexity:
342
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#:
N/A
Hazard Statements:
H302-H315-H319-H332-H335
Precautionary Statements:
P233-P260-P261-P264-P270-P271-P280-P301+P312-P302+P352-P304-P304+P340-P305+P351+P338-P312-P321-P330-P332+P313-P337+P313-P340-P362-P403-P403+P233-P405-P501
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


Request for Quotation


Customer Feedback


Chemical Structure



N-Boc-Indole-2-Boronic Acid, a versatile chemical compound widely employed in organic synthesis, plays a pivotal role in the creation of complex molecules with diverse applications. This compound serves as a crucial building block in the preparation of pharmaceuticals, agrochemicals, and materials due to its ability to engage in various coupling reactions. Through Suzuki-Miyaura cross-coupling reactions, N-Boc-Indole-2-Boronic Acid can be utilized to form carbon-carbon bonds, facilitating the construction of new carbon frameworks. Additionally, this compound is instrumental in the synthesis of biologically active compounds, natural products, and functional materials, making it an indispensable tool for chemists seeking to access structurally intricate molecules efficiently and selectively. By leveraging the unique reactivity and versatility of N-Boc-Indole-2-Boronic Acid, researchers and synthetic chemists can unlock new pathways for the development of cutting-edge technologies and innovative solutions in the field of chemistry.