2,3-bis(hydroxymethyl)quinoxaline-1,4-diium-1,4-bis(olate)

2,3-bis(hydroxymethyl)quinoxaline-1,4-diium-1,4-bis(olate)

CAS: 17311-31-8

Formula: C10H10N2O4

SMILES: OCC1=[N+]([O-])C2=CC=CC=C2[N+]([O-])=C1CO

IUPAC: 2,3-bis(hydroxymethyl)quinoxaline-1,4-diium-1,4-bis(olate)

InChI: InChI=1S/C10H10N2O4/c13-5-9-10(6-14)12(16)8-4-2-1-3-7(8)11(9)15/h1-4,13-14H,5-6H2

Composition: C (54.05%), H (4.54%), N (12.61%), O (28.80%)

Molar Mass: 222.2

Atom Count: 26

Heavy Atom Count: 16

Properties

Properties

Common Names	N/A
Aromatic Ring Count	2
Asymmetric Atom Count	0
Exact Mass	222.06405681
Formal Charge	0
FSP3	0.2
Hetero Ring Count	1
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	2
InChIKey	DOIGHQCAQBRSKI-UHFFFAOYSA-N
Lipinski's Rule of Five	1
Molar Refractivity	57.66
Topological Polar Surface Area	94.34
Polarizability	21.95
Ring Count	2
Rotatable Bond Count	2

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