6-(3-methylphenoxy)pyridin-3-ylboronic acid

6-(3-methylphenoxy)pyridin-3-ylboronic acid

CAS: 1793003-62-9

Formula: C12H12BNO3

SMILES: CC1=CC=CC(OC2=CC=C(C=N2)B(O)O)=C1

IUPAC: [6-(3-methylphenoxy)pyridin-3-yl]boronic acid

InChI: InChI=1S/C12H12BNO3/c1-9-3-2-4-11(7-9)17-12-6-5-10(8-14-12)13(15)16/h2-8,15-16H,1H3

Composition: C (62.93%), H (5.28%), B (4.72%), N (6.12%), O (20.96%)

Molar Mass: 229.04

Atom Count: 29

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	229.091023
Formal Charge	0
FSP3	0.08
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	PDBLSVZYYLJCIH-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	60.04
Topological Polar Surface Area	62.58
Polarizability	24.73
Ring Count	2
Rotatable Bond Count	3

Suppliers

Molecule Market Select

Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	1793003-62-9		$64.31-$510.71$64.31$168.97$510.71