4-hydroxy-3-nitrophenylboronic acid

4-hydroxy-3-nitrophenylboronic acid

CAS: 850568-75-1

Formula: C6H6BNO5

SMILES: OB(O)C1=CC=C(O)C(=C1)[N+]([O-])=O

IUPAC: (4-hydroxy-3-nitrophenyl)boronic acid

InChI: InChI=1S/C6H6BNO5/c9-6-2-1-4(7(10)11)3-5(6)8(12)13/h1-3,9-11H

Composition: C (39.40%), H (3.31%), B (5.91%), N (7.66%), O (43.73%)

Molar Mass: 182.93

Atom Count: 19

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	183.033902
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	GEQDFOXXEZKEPZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	38.9
Topological Polar Surface Area	103.83
Polarizability	16.14
Ring Count	1
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<7 Days	850568-75-1		$44.51-$181.13$44.51$73.49$181.13

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98%	<5 Days	850568-75-1		$78.18-$117.27$78.18$117.27