N-{2-[(2-nitrophenyl)amino]ethyl}methanesulfonamide

N-{2-[(2-nitrophenyl)amino]ethyl}methanesulfonamide

Formula: C9H13N3O4S

SMILES: CS(=O)(=O)NCCNC1=CC=CC=C1[N+]([O-])=O

IUPAC: N-{2-[(2-nitrophenyl)amino]ethyl}methanesulfonamide

InChI: InChI=1S/C9H13N3O4S/c1-17(15,16)11-7-6-10-8-4-2-3-5-9(8)12(13)14/h2-5,10-11H,6-7H2,1H3

Composition: C (41.69%), H (5.05%), N (16.21%), O (24.68%), S (12.37%)

Molar Mass: 259.28

Atom Count: 30

Heavy Atom Count: 17

Properties

Properties

Common Names	N/A
Aromatic Ring Count	1
Asymmetric Atom Count	0
Exact Mass	259.062677085
Formal Charge	0
FSP3	0.33
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	HPNDTXOGSGLBEE-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	63.57
Topological Polar Surface Area	101.34
Polarizability	24.3
Ring Count	1
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C9H13N3O4S		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00