N-(2-methyl-3-nitrophenyl)-4-phenoxybutanamide

N-(2-methyl-3-nitrophenyl)-4-phenoxybutanamide

Formula: C17H18N2O4

SMILES: CC1=C(C=CC=C1NC(=O)CCCOC1=CC=CC=C1)[N+]([O-])=O

IUPAC: N-(2-methyl-3-nitrophenyl)-4-phenoxybutanamide

InChI: InChI=1S/C17H18N2O4/c1-13-15(9-5-10-16(13)19(21)22)18-17(20)11-6-12-23-14-7-3-2-4-8-14/h2-5,7-10H,6,11-12H2,1H3,(H,18,20)

Composition: C (64.96%), H (5.77%), N (8.91%), O (20.36%)

Molar Mass: 314.341

Atom Count: 41

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	314.126657068
Formal Charge	0
FSP3	0.24
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	1
InChIKey	LGBXPIJELSNQSB-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	87.7
Topological Polar Surface Area	81.47
Polarizability	32.8
Ring Count	2
Rotatable Bond Count	7

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C17H18N2O4		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00