6-nitroquinoxaline-2-carboxylic acid

6-nitroquinoxaline-2-carboxylic acid

Formula: C9H5N3O4

SMILES: OC(=O)C1=CN=C2C=C(C=CC2=N1)[N+]([O-])=O

IUPAC: 6-nitroquinoxaline-2-carboxylic acid

InChI: InChI=1S/C9H5N3O4/c13-9(14)8-4-10-7-3-5(12(15)16)1-2-6(7)11-8/h1-4H,(H,13,14)

Composition: C (49.33%), H (2.30%), N (19.17%), O (29.20%)

Molar Mass: 219.156

Atom Count: 21

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	219.028005653
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	6
Hydrogen Bond Donor Count	1
InChIKey	RYYYGQBDEGUYLX-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	50.66
Topological Polar Surface Area	106.22
Polarizability	20.34
Ring Count	2
Rotatable Bond Count	2

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Purity	LeadTime	Formula		UnitPrice
98%	<10 Days	C9H5N3O4		Quote Only