5-methyl-2-[4-(4-nitrophenoxy)benzamido]benzoic acid

5-methyl-2-[4-(4-nitrophenoxy)benzamido]benzoic acid

Formula: C21H16N2O6

SMILES: CC1=CC=C(NC(=O)C2=CC=C(OC3=CC=C(C=C3)[N+]([O-])=O)C=C2)C(=C1)C(O)=O

IUPAC: 5-methyl-2-[4-(4-nitrophenoxy)benzamido]benzoic acid

InChI: InChI=1S/C21H16N2O6/c1-13-2-11-19(18(12-13)21(25)26)22-20(24)14-3-7-16(8-4-14)29-17-9-5-15(6-10-17)23(27)28/h2-12H,1H3,(H,22,24)(H,25,26)

Composition: C (64.28%), H (4.11%), N (7.14%), O (24.47%)

Molar Mass: 392.367

Atom Count: 45

Heavy Atom Count: 29

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	392.100836243
Formal Charge	0
FSP3	0.05
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	BITQZYNQPLCOEV-UHFFFAOYSA-N
Lipinski's Rule of Five
Molar Refractivity	106.45
Topological Polar Surface Area	118.77
Polarizability	39.26
Ring Count	3
Rotatable Bond Count	6

Suppliers

Molecule Market Select

Purity	LeadTime	Formula	PacketSize	UnitPrice
90%	<16 Days	C21H16N2O6		$33.80-$156.00$33.80$52.00$67.60$93.60$156.00