tert-butyl 5-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole-1-carboxylate


Chemical Name: tert-butyl 5-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indole-1-carboxylate
CAS Number: 1218790-30-7
Product Number: AG00168X(AGN-PC-09PZM3)
Synonyms:
MDL No:
Molecular Formula: C19H25BClNO4
Molecular Weight: 377.6701

Identification/Properties


Properties
Storage:
Keep in dry area;-10 ℃;
Form:
Solid
Computed Properties
Molecular Weight:
377.672g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
4
Rotatable Bond Count:
3
Exact Mass:
377.157g/mol
Monoisotopic Mass:
377.157g/mol
Topological Polar Surface Area:
49.7A^2
Heavy Atom Count:
26
Formal Charge:
0
Complexity:
546
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-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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Chemical Structure



In chemical synthesis, tert-Butyl 5-chloro-3-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indole-1-carboxylate serves as a valuable building block for creating complex organic compounds. This compound can be utilized for introducing both the indole and boronic ester functionalities into target molecules, making it a versatile reagent for constructing diverse chemical structures. Its unique structural features make it particularly useful in the synthesis of biologically active compounds and materials with advanced properties.