3-methyl-2H-indazol-6-ylboronic acid

3-methyl-2H-indazol-6-ylboronic acid

CAS: 1245816-26-5

Formula: C8H9BN2O2

SMILES: CC1=C2C=CC(=CC2=NN1)B(O)O

IUPAC: (3-methyl-2H-indazol-6-yl)boronic acid

InChI: InChI=1S/C8H9BN2O2/c1-5-7-3-2-6(9(12)13)4-8(7)11-10-5/h2-4,12-13H,1H3,(H,10,11)

Composition: C (54.60%), H (5.16%), B (6.14%), N (15.92%), O (18.18%)

Molar Mass: 175.98

Atom Count: 22

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	176.075708
Formal Charge	0
FSP3	0.12
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	BILMNHWUQJFDED-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	45.52
Topological Polar Surface Area	69.14
Polarizability	19.62
Ring Count	2
Rotatable Bond Count	1

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