1-methanesulfonyl-2-methyl-4-(4-nitrophenyl)piperazine

1-methanesulfonyl-2-methyl-4-(4-nitrophenyl)piperazine

Formula: C12H17N3O4S

SMILES: CC1CN(CCN1S(C)(=O)=O)C1=CC=C(C=C1)[N+]([O-])=O

IUPAC: 1-methanesulfonyl-2-methyl-4-(4-nitrophenyl)piperazine

InChI: InChI=1/C12H17N3O4S/c1-10-9-13(7-8-14(10)20(2,18)19)11-3-5-12(6-4-11)15(16)17/h3-6,10H,7-9H2,1-2H3

Composition: C (48.15%), H (5.72%), N (14.04%), O (21.38%), S (10.71%)

Molar Mass: 299.35

Atom Count: 37

Heavy Atom Count: 20

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	1
Exact Mass	299.093977213
Formal Charge	0
FSP3	0.5
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	0
InChIKey	RMCUBOLBZPKZKY-UHFFFAOYNA-N
Lipinski's Rule of Five	1
Molar Refractivity	75.15
Topological Polar Surface Area	83.76
Polarizability	29.05
Ring Count	2
Rotatable Bond Count	2

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C12H17N3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00