Pyrazine N-oxide

CAT: 0024-sc-236517Size: 1 gDry Ice: NoHazardous: No

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CAT#:0024-sc-236517Size:1 g

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CAS Number

2423-65-6

Chemical Information

Pyrazine 1-oxide

CAS Number	2423-65-6
PubChem CID	137595
IUPAC Name	1-oxidopyrazin-1-ium
Molecular Formula	C4H4N2O
Molecular Weight	96.09
XLogP	-1.2
Topological Polar Surface Area	38.4
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Heavy Atom Count	7
Formal Charge	0
Complexity	51

SMILES

C1=C[N+](=CC=N1)[O-]

InChI

InChI=1S/C4H4N2O/c7-6-3-1-5-2-4-6/h1-4H

InChIKey

RUIZBQQGWNBRFH-UHFFFAOYSA-N

Chemical Structure

2D Structure

CAS: 2423-65-6

CID: 137595

Formula: C4H4N2O

MW: 96.09

Interactive 3D Structure

Loading 3D structure...

Computed Properties

Property	Value
Molecular Weight	96.09
XLogP3	-1.2
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	96.032362755
Monoisotopic Mass	96.032362755
Topological Polar Surface Area	38.4 Å²
Heavy Atom Count	7
Formal Charge	0
Complexity	51.7
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently-Bonded Unit Count	1
Compound Is Canonicalized	Yes

Catalog	Name
sc-250813	Pyridazine N-oxide
sc-250817	Pyridine N-oxide
sc-250813A	Pyridazine N-oxide
sc-211260	Desloratadine Pyridine N-oxide
sc-211631	Imatinib (Pyridine) -N-oxide
sc-212606	Pyridine-N-oxide-d5
sc-232258	4- (Benzyloxy) pyridine N-oxide
sc-391966	2- (Hydroxymethyl) pyridine N-Oxide
sc-215498	N, N-Dimethyldodecylamine N-oxide
sc-250526	N, N-Dimethylundecylamine N-oxide

Catalog	Name
OR1014857-01	Pyrazine 1-Oxide
420432-01	2,5-Bis (2- (benzyloxy) ethyl) pyrazine N-Oxide
B410930	2,5-Bis(2-(benzyloxy)ethyl)pyrazine N-Oxide
OR346029-01	Pyrazine-2-N-cyanoamidine
BG FA 0604-01	N- (hydroxymethyl) pyrazine-2-carbothioamide
416970-01	2-Chloro-6- (N, N-diethylamino) pyrazine
416971-01	2-Chloro-6- (N, N-dipropylamino) pyrazine
MBS5803039	N'-(2-Fluorophenyl)pyrazine-2-carbohydrazide
HY-145437	N'- (2-Fluorophenyl) pyrazine-2-carbohydrazide
BG FA 1005-01	Methyl N-methyl-N- (pyrazine-2-carbonylamino) carbamodithioate