3-amino-4'-(3-amino-4-carboxyphenyl)-[1,1'-biphenyl]-4-carboxylic acid

3-amino-4'-(3-amino-4-carboxyphenyl)-[1,1'-biphenyl]-4-carboxylic acid

CAS: 2101636-51-3

Formula: C20H16N2O4

SMILES: NC1=CC(=CC=C1C(O)=O)C1=CC=C(C=C1)C1=CC=C(C(O)=O)C(N)=C1

IUPAC: 3-amino-4'-(3-amino-4-carboxyphenyl)-[1,1'-biphenyl]-4-carboxylic acid

InChI: InChI=1S/C20H16N2O4/c21-17-9-13(5-7-15(17)19(23)24)11-1-2-12(4-3-11)14-6-8-16(20(25)26)18(22)10-14/h1-10H,21-22H2,(H,23,24)(H,25,26)

Composition: C (68.96%), H (4.63%), N (8.04%), O (18.37%)

Molar Mass: 348.358

Atom Count: 42

Heavy Atom Count: 26

Properties

Properties

Common Names	N/A
Aromatic Ring Count	3
Asymmetric Atom Count	0
Exact Mass	348.111007003
Formal Charge	0
FSP3	0
Hetero Ring Count	0
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	4
InChIKey	TVJAEPMTJSNWLY-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	100.24
Topological Polar Surface Area	126.64
Polarizability	39.16
Ring Count	3
Rotatable Bond Count	4

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Purity	LeadTime	CAS	PacketSize	UnitPrice
97%	<5 Days	2101636-51-3		$93.31-$330.38$93.31$138.71$330.38