3,5-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tosyl-1H-indazole


Chemical Name: 3,5-Dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1-tosyl-1H-indazole
CAS Number: 1421252-90-5
Product Number: AG001HTA(AGN-PC-0WAMCR)
Synonyms:
MDL No: MFCD28130306
Molecular Formula: C22H27BN2O4S
Molecular Weight: 426.3368

Identification/Properties


Computed Properties
Molecular Weight:
426.338g/mol
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
426.178g/mol
Monoisotopic Mass:
426.178g/mol
Topological Polar Surface Area:
78.8A^2
Heavy Atom Count:
30
Formal Charge:
0
Complexity:
729
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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