4-(piperidine-1-sulfonyl)phenylboronic acid

4-(piperidine-1-sulfonyl)phenylboronic acid

CAS: 486422-58-6

Formula: C11H16BNO4S

SMILES: OB(O)C1=CC=C(C=C1)S(=O)(=O)N1CCCCC1

IUPAC: [4-(piperidine-1-sulfonyl)phenyl]boronic acid

InChI: InChI=1S/C11H16BNO4S/c14-12(15)10-4-6-11(7-5-10)18(16,17)13-8-2-1-3-9-13/h4-7,14-15H,1-3,8-9H2

Composition: C (49.09%), H (5.99%), B (4.02%), N (5.20%), O (23.78%), S (11.91%)

Molar Mass: 269.12

Atom Count: 34

Heavy Atom Count: 18

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	269.089309
Formal Charge	0
FSP3	0.45
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	MIEADZYHESCCES-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	64.7
Topological Polar Surface Area	77.84
Polarizability	27.32
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	CAS	PacketSize	UnitPrice
98%	<5 Days	486422-58-6		$42.87-$435.05$42.87$112.23$435.05