2-[(4-ethoxyphenyl)amino]-4-nitrobenzoic acid

2-[(4-ethoxyphenyl)amino]-4-nitrobenzoic acid

CAS: 74859-51-1

Formula: C15H14N2O5

SMILES: CCOC1=CC=C(NC2=CC(=CC=C2C(O)=O)[N+]([O-])=O)C=C1

IUPAC: 2-[(4-ethoxyphenyl)amino]-4-nitrobenzoic acid

InChI: InChI=1S/C15H14N2O5/c1-2-22-12-6-3-10(4-7-12)16-14-9-11(17(20)21)5-8-13(14)15(18)19/h3-9,16H,2H2,1H3,(H,18,19)

Composition: C (59.60%), H (4.67%), N (9.27%), O (26.46%)

Molar Mass: 302.286

Atom Count: 36

Heavy Atom Count: 22

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	302.090271559
Formal Charge	0
FSP3	0.13
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	2
InChIKey	DBRBTLBVIHPZLM-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	79.33
Topological Polar Surface Area	101.7
Polarizability	29.67
Ring Count	2
Rotatable Bond Count	6

Suppliers

Key Organics Ltd

Supplier Profile

Purity	LeadTime	CAS	PacketSize	UnitPrice
95%	<2 Days	74859-51-1		$305.90-$666.43$305.90$305.90$518.94$518.94$666.43$666.43