6-(piperazin-1-yl)pyridin-3-ylboronic acid hydrochloride

6-(piperazin-1-yl)pyridin-3-ylboronic acid hydrochloride

Formula: C9H15BClN3O2

SMILES: Cl.OB(O)C1=CN=C(C=C1)N1CCNCC1

IUPAC: [6-(piperazin-1-yl)pyridin-3-yl]boronic acid hydrochloride

InChI: InChI=1S/C9H14BN3O2.ClH/c14-10(15)8-1-2-9(12-7-8)13-5-3-11-4-6-13;/h1-2,7,11,14-15H,3-6H2;1H

Composition: C (44.39%), H (6.21%), B (4.44%), Cl (14.56%), N (17.26%), O (13.14%)

Molar Mass: 243.5

Atom Count: 31

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	243.094584
Formal Charge	0
FSP3	0.44
Hetero Ring Count	2
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	3
InChIKey	CCKBMQAIFGZRCQ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	53.94
Topological Polar Surface Area	68.62
Polarizability	21.94
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H15BClN3O2		Quote Only