1-(naphthalene-2-sulfonyl)piperidine-4-carboxylic acid

1-(naphthalene-2-sulfonyl)piperidine-4-carboxylic acid

Formula: C16H17NO4S

SMILES: OC(=O)C1CCN(CC1)S(=O)(=O)C1=CC2=CC=CC=C2C=C1

IUPAC: 1-(naphthalene-2-sulfonyl)piperidine-4-carboxylic acid

InChI: InChI=1S/C16H17NO4S/c18-16(19)13-7-9-17(10-8-13)22(20,21)15-6-5-12-3-1-2-4-14(12)11-15/h1-6,11,13H,7-10H2,(H,18,19)

Composition: C (60.17%), H (5.37%), N (4.39%), O (20.04%), S (10.04%)

Molar Mass: 319.38

Atom Count: 39

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	319.087829205
Formal Charge	0
FSP3	0.31
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	MDJITYWHEVEXJY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	82.84
Topological Polar Surface Area	74.68
Polarizability	33.94
Ring Count	3
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H17NO4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00