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6-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole

6-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole

CAS: 2243949-54-2

Formula: C14H19BN2O3

SMILES: COC1=C(C=C2C=NNC2=C1)B1OC(C)(C)C(C)(C)O1

IUPAC: 6-methoxy-5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1H-indazole

InChI: InChI=1S/C14H19BN2O3/c1-13(2)14(3,4)20-15(19-13)10-6-9-8-16-17-11(9)7-12(10)18-5/h6-8H,1-5H3,(H,16,17)

Composition: C (61.34%), H (6.99%), B (3.94%), N (10.22%), O (17.51%)

Molar Mass: 274.13

Atom Count: 39

Heavy Atom Count: 20

Properties
Properties
Common Names N/A
Aromatic Ring Count 2
Asymmetric Atom Count 0
Exact Mass 274.148872
Formal Charge 0
FSP3 0.5
Hetero Ring Count 2
Hydrogen Bond Acceptor Count 4
Hydrogen Bond Donor Count 1
InChIKey MSPPJQVYOORZKS-UHFFFAOYSA-N
Lipinski's Rule of Five 1
Molar Refractivity 72.19
Topological Polar Surface Area 56.37
Polarizability 30.83
Ring Count 3
Rotatable Bond Count 2

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