Home Boronic acids 7-Fluoro-1H-indazole-4-boronic acid pinacol ester

7-Fluoro-1H-indazole-4-boronic acid pinacol ester

CAS No.:
1186334-64-4
Catalog Number:
AG0095OA
Molecular Formula:
C13H16BFN2O2
Molecular Weight:
262.0877
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Product Description
Catalog Number:
AG0095OA
Chemical Name:
7-Fluoro-1H-indazole-4-boronic acid pinacol ester
CAS Number:
1186334-64-4
Molecular Formula:
C13H16BFN2O2
Molecular Weight:
262.0877
IUPAC Name:
7-fluoro-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole
InChI:
InChI=1S/C13H16BFN2O2/c1-12(2)13(3,4)19-14(18-12)9-5-6-10(15)11-8(9)7-16-17-11/h5-7H,1-4H3,(H,16,17)
InChI Key:
RAQASWRRBFTDND-UHFFFAOYSA-N
SMILES:
Fc1ccc(c2c1[nH]nc2)B1OC(C(O1)(C)C)(C)C
Properties
Complexity:
351  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
262.129g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
262.091g/mol
Monoisotopic Mass:
262.129g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
47.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties