pyrazine-2-carboxamidine hydrochloride - CAS 138588-41-7

Catalog:	BB008817
Product Name:	pyrazine-2-carboxamidine hydrochloride
CAS:	138588-41-7
Synonyms:	2-pyrazinecarboximidamide;hydrochloride; pyrazine-2-carboximidamide;hydrochloride

Technical Data

Safety and Hazards

Patents

Computed Properties

IUPAC Name:	pyrazine-2-carboximidamide;hydrochloride
Description:	pyrazine-2-carboxamidine hydrochloride (CAS# 138588-41-7) is a useful research chemical.
Molecular Weight:	158.59
Molecular Formula:	C5H7ClN4
Canonical SMILES:	C1=CN=C(C=N1)C(=N)N.Cl
InChI:	InChI=1S/C5H6N4.ClH/c6-5(7)4-3-8-1-2-9-4;/h1-3H,(H3,6,7);1H
InChI Key:	FCVKLVNLBIBCCU-UHFFFAOYSA-N
Boiling Point:	253.5 °C at 760 mmHg
Purity:	95 %
LogP:	1.36270

Publication Number	Title	Priority Date
WO-2021144304-A1	Disperse azo dyes, a process for the preparation thereof and the use thereof	20200115
WO-2021018869-A1	1,2,4-oxadiazol-5-one derivatives for the treatment of cancer	20190729
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WO-2020219871-A1	Heterocyclic compounds and their use for treatment of helminthic infections and diseases	20190426
WO-2020132636-A1	Analogues of pentamidine and uses therefor	20181220

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Related Functional Groups

Pyrazines

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4-amino-N-(5-chloropyrazin-2-yl)benzenesulfonamide hydrochloride
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1-(2-Pyrazinyl)ethanol
[1006491-92-4]
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GHS Hazard Statement:	H302 (100%): Harmful if swallowed [Warning Acute toxicity, oral]
Precautionary Statement:	P261, P264, P270, P271, P280, P301+P312, P302+P352, P304+P340, P305+P351+P338, P312, P321, P330, P332+P313, P337+P313, P362, P403+P233, P405, and P501
Signal Word:	Warning

Complexity:	112
Compound Is Canonicalized:	Yes
Covalently-Bonded Unit Count:	2
Defined Atom Stereocenter Count:	0
Defined Bond Stereocenter Count:	0
Exact Mass:	158.0359239
Formal Charge:	0
Heavy Atom Count:	10
Hydrogen Bond Acceptor Count:	3
Hydrogen Bond Donor Count:	3
Isotope Atom Count:	0
Monoisotopic Mass:	158.0359239
Rotatable Bond Count:	1
Topological Polar Surface Area:	75.6 Å²
Undefined Atom Stereocenter Count:	0
Undefined Bond Stereocenter Count:	0