1,4-dimethyl 2-[2-(4-nitrophenyl)acetamido]benzene-1,4-dicarboxylate

1,4-dimethyl 2-[2-(4-nitrophenyl)acetamido]benzene-1,4-dicarboxylate

Formula: C18H16N2O7

SMILES: COC(=O)C1=CC=C(C(=O)OC)C(NC(=O)CC2=CC=C(C=C2)[N+]([O-])=O)=C1

IUPAC: 1,4-dimethyl 2-[2-(4-nitrophenyl)acetamido]benzene-1,4-dicarboxylate

InChI: InChI=1S/C18H16N2O7/c1-26-17(22)12-5-8-14(18(23)27-2)15(10-12)19-16(21)9-11-3-6-13(7-4-11)20(24)25/h3-8,10H,9H2,1-2H3,(H,19,21)

Composition: C (58.07%), H (4.33%), N (7.52%), O (30.08%)

Molar Mass: 372.333

Atom Count: 43

Heavy Atom Count: 27

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	372.095750863
Formal Charge	0
FSP3	0.17
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	1
InChIKey	OGUAAAMVMDAZMZ-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	96.01
Topological Polar Surface Area	124.84
Polarizability	35.62
Ring Count	2
Rotatable Bond Count	8

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C18H16N2O7		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00