2-chloro-4-hydroxyphenylboronic acid

2-chloro-4-hydroxyphenylboronic acid

CAS: 766549-26-2

Formula: C6H6BClO3

SMILES: OB(O)C1=CC=C(O)C=C1Cl

IUPAC: (2-chloro-4-hydroxyphenyl)boronic acid

InChI: InChI=1S/C6H6BClO3/c8-6-3-4(9)1-2-5(6)7(10)11/h1-3,9-11H

Composition: C (41.81%), H (3.51%), B (6.27%), Cl (20.57%), O (27.85%)

Molar Mass: 172.37

Atom Count: 17

Heavy Atom Count: 11

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	172.009852
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	3
Hydrogen Bond Donor Count	3
InChIKey	NRBQMBXPVAUMJY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	37.39
Topological Polar Surface Area	60.69
Polarizability	16.08
Ring Count	1
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<7 Days	766549-26-2		$76.67-$972.40$76.67$279.57$972.40

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98%	<5 Days	766549-26-2		$30.26-$345.51$30.26$47.92$94.58$345.51