Home Carboxys 1H-Indazole-1-carboxylic acid, 6-fluoro-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1,1-dimethylethyl ester

1H-Indazole-1-carboxylic acid, 6-fluoro-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1,1-dimethylethyl ester

CAS No.:
1333222-21-1
Catalog Number:
AG0014N7
Molecular Formula:
C19H26BFN2O4
Molecular Weight:
376.2301
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Product Description
Catalog Number:
AG0014N7
Chemical Name:
1H-Indazole-1-carboxylic acid, 6-fluoro-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-, 1,1-dimethylethyl ester
CAS Number:
1333222-21-1
Molecular Formula:
C19H26BFN2O4
Molecular Weight:
376.2301
MDL Number:
MFCD17677331
IUPAC Name:
tert-butyl 6-fluoro-3-methyl-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)indazole-1-carboxylate
InChI:
InChI=1S/C19H26BFN2O4/c1-11-12-9-13(20-26-18(5,6)19(7,8)27-20)14(21)10-15(12)23(22-11)16(24)25-17(2,3)4/h9-10H,1-8H3
InChI Key:
NDPGUOHOTNZQAM-UHFFFAOYSA-N
SMILES:
Fc1cc2c(cc1B1OC(C(O1)(C)C)(C)C)c(nn2C(=O)OC(C)(C)C)C
Properties
Complexity:
579  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
376.197g/mol
Formal Charge:
0
Heavy Atom Count:
27  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
376.235g/mol
Monoisotopic Mass:
376.197g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
62.6A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Properties