6-nitroquinoxaline

6-nitroquinoxaline

CAS: 6639-87-8

Formula: C8H5N3O2

SMILES: [O-][N+](=O)C1=CC2=NC=CN=C2C=C1

IUPAC: 6-nitroquinoxaline

InChI: InChI=1S/C8H5N3O2/c12-11(13)6-1-2-7-8(5-6)10-4-3-9-7/h1-5H

Composition: C (54.86%), H (2.88%), N (23.99%), O (18.27%)

Molar Mass: 175.147

Atom Count: 18

Heavy Atom Count: 13

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	175.038176413
Formal Charge	0
FSP3	0
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
InChIKey	YLKFDRWBZAALPN-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	43.77
Topological Polar Surface Area	68.92
Polarizability	17.92
Ring Count	2
Rotatable Bond Count	1

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