3-aminoquinoxaline-2-carboxylic acid

3-aminoquinoxaline-2-carboxylic acid

CAS: 85414-82-0

Formula: C9H7N3O2

SMILES: NC1=NC2=CC=CC=C2N=C1C(O)=O

IUPAC: 3-aminoquinoxaline-2-carboxylic acid

InChI: InChI=1S/C9H7N3O2/c10-8-7(9(13)14)11-5-3-1-2-4-6(5)12-8/h1-4H,(H2,10,12)(H,13,14)

Composition: C (57.14%), H (3.73%), N (22.21%), O (16.91%)

Molar Mass: 189.174

Atom Count: 21

Heavy Atom Count: 14

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	189.053826477
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	5
Hydrogen Bond Donor Count	2
InChIKey	WINJFUJIPMQGNL-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	49.35
Topological Polar Surface Area	89.1
Polarizability	19.53
Ring Count	2
Rotatable Bond Count	1

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Purity	LeadTime	CAS	PacketSize	UnitPrice
96%	<2 Days	85414-82-0		$171.35-$3,668.50$171.35$227.70$342.70$572.70$917.70$3,668.50