Pyrazine-2-amidoxime - CAS 51285-05-3

Catalog:	BB027393
Product Name:	Pyrazine-2-amidoxime
CAS:	51285-05-3
Synonyms:	N'-hydroxypyrazine-2-carboximidamide

Technical Data

Safety and Hazards

Literatures

Computed Properties

IUPAC Name:	N'-hydroxypyrazine-2-carboximidamide
Description:	Pyrazine-2-amidoxime (CAS# 51285-05-3) is a useful research chemical.
Molecular Weight:	138.13
Molecular Formula:	C5H6N4O
Canonical SMILES:	C1=CN=C(C=N1)C(=NO)N
InChI:	InChI=1S/C5H6N4O/c6-5(9-10)4-3-7-1-2-8-4/h1-3,10H,(H2,6,9)
InChI Key:	QZHJCRJEMIFNNB-UHFFFAOYSA-N
Boiling Point:	370.305 °C at 760 mmHg
Density:	1.493 g/cm³
LogP:	0.27140

PMID	Publication Date	Title	Journal
21175167	20110207	Pyrazine-2-amidoxime Ni(II) complexes: from ferromagnetic cluster to antiferromagnetic layer	Inorganic chemistry

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Related Functional Groups

Pyrazines

[56423-63-3]
2-Bromopyrazine
[1869118-24-0]
Ethyl {5-[(4-methylphenyl)sulfonyl]-5H-pyrrolo[2,3-b]pyrazin-2-yl}carbamate
[4949-13-7]
Fluoropyrazine
[36588-50-8]
(R)-hexahydro-1H-pyrido[1,2-a]pyrazine-1,4(6H)-dione
[1383427-89-1]
(R)-Hexahydropyrazino[2,1-c][1,4]oxazin-4(3H)-one hydrochloride
[273-94-9]
1H-Imidazo[4,5-b]pyrazine

GHS Hazard Statement:	H301 (97.44%): Toxic if swallowed [Danger Acute toxicity, oral]; H315 (100%): Causes skin irritation [Warning Skin corrosion/irritation]; H318 (97.44%): Causes serious eye damage [Danger Serious eye damage/eye irritation]; H335 (100%): May cause respiratory irritation [Warning Specific target organ toxicity, single exposure; Respiratory tract irritation]
Precautionary Statement:	P261, P264, P264+P265, P270, P271, P280, P301+P316, P302+P352, P304+P340, P305+P354+P338, P317, P319, P321, P330, P332+P317, P362+P364, P403+P233, P405, and P501
Signal Word:	Danger

Complexity:	136
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	1
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	1
Exact Mass:	138.05416083
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	4
Hydrogen Bond Donor Count:	2
Isotope Atom Count:	0
Monoisotopic Mass:	138.05416083
Rotatable Bond Count:	1
Topological Polar Surface Area:	84.4
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0
XLogP3:	-0.3