4-methyl-1-(4-nitrobenzenesulfonyl)piperidine

4-methyl-1-(4-nitrobenzenesulfonyl)piperidine

Formula: C12H16N2O4S

SMILES: CC1CCN(CC1)S(=O)(=O)C1=CC=C(C=C1)[N+]([O-])=O

IUPAC: 4-methyl-1-(4-nitrobenzenesulfonyl)piperidine

InChI: InChI=1S/C12H16N2O4S/c1-10-6-8-13(9-7-10)19(17,18)12-4-2-11(3-5-12)14(15)16/h2-5,10H,6-9H2,1H3

Composition: C (50.69%), H (5.67%), N (9.85%), O (22.51%), S (11.28%)

Molar Mass: 284.33

Atom Count: 35

Heavy Atom Count: 19

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	284.083078177
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	KMPYGZSGASXYPW-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	71.02
Topological Polar Surface Area	80.52
Polarizability	27.86
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H16N2O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00