2-methoxy-4,6-dimethylphenylboronic acid

2-methoxy-4,6-dimethylphenylboronic acid

CAS: 355836-08-7

Formula: C9H13BO3

SMILES: COC1=CC(C)=CC(C)=C1B(O)O

IUPAC: (2-methoxy-4,6-dimethylphenyl)boronic acid

InChI: InChI=1S/C9H13BO3/c1-6-4-7(2)9(10(11)12)8(5-6)13-3/h4-5,11-12H,1-3H3

Composition: C (60.05%), H (7.28%), B (6.01%), O (26.66%)

Molar Mass: 180.01

Atom Count: 26

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	180.095774
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	2
InChIKey	UFFAFBPZFGAMJJ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	47.15
Topological Polar Surface Area	49.69
Polarizability	19.58
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	355836-08-7		$71.88-$900.35$71.88$182.85$564.93$900.35