N-(2H-1,3-benzodioxol-5-ylmethyl)-2-(2-nitrophenyl)acetamide

N-(2H-1,3-benzodioxol-5-ylmethyl)-2-(2-nitrophenyl)acetamide

Formula: C16H14N2O5

SMILES: [O-][N+](=O)C1=CC=CC=C1CC(=O)NCC1=CC=C2OCOC2=C1

IUPAC: N-[(2H-1,3-benzodioxol-5-yl)methyl]-2-(2-nitrophenyl)acetamide

InChI: InChI=1S/C16H14N2O5/c19-16(8-12-3-1-2-4-13(12)18(20)21)17-9-11-5-6-14-15(7-11)23-10-22-14/h1-7H,8-10H2,(H,17,19)

Composition: C (61.14%), H (4.49%), N (8.91%), O (25.45%)

Molar Mass: 314.297

Atom Count: 37

Heavy Atom Count: 23

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	314.090271559
Formal Charge	0
FSP3	0.19
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	LIRSUYKAUMQUQA-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	80.78
Topological Polar Surface Area	90.7
Polarizability	31.03
Ring Count	3
Rotatable Bond Count	5

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C16H14N2O5		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00