5-methylpyridin-3-ylboronic acid

5-methylpyridin-3-ylboronic acid

CAS: 173999-18-3

Formula: C6H8BNO2

SMILES: CC1=CC(=CN=C1)B(O)O

IUPAC: (5-methylpyridin-3-yl)boronic acid

InChI: InChI=1S/C6H8BNO2/c1-5-2-6(7(9)10)4-8-3-5/h2-4,9-10H,1H3

Composition: C (52.62%), H (5.89%), B (7.89%), N (10.23%), O (23.37%)

Molar Mass: 136.95

Atom Count: 18

Heavy Atom Count: 10

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	137.064809
Formal Charge	0
FSP3	0.17
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	REONQWGHSQHTAC-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	33.49
Topological Polar Surface Area	53.35
Polarizability	14.4
Ring Count	1
Rotatable Bond Count	1

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