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Pyrithione - 96%, high purity , CAS No.1121-30-8

COA

Grade & Purity:

Moligand™

≥96%

Cas Number: 1121-30-8
Molecular Weight: 127.16
EC Number: 214-329-4,214-328-9
PubChem CID: 1570

In stock

Item Number

P649027

Grouped product items
SKU	Size	Availability	Price
P649027-10mg	10mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$24.90
P649027-50mg	50mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$49.90
P649027-250mg	250mg	Available within 8-12 weeks(?) Production requires sourcing of materials. We appreciate your patience and understanding.	$95.90

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Basic Description

Synonyms	2-Mercaptopyridine monoxide \| cid_1570 \| 2-SULFANYLPYRIDIN-1-IUM-1-OLATE \| NCGC00246995-01 \| NSC179790 \| NSC-179790 \| Pyridine-2-thiol-1-oxide \| 1-Hydroxy-2-pyridinethione \| 2-mercaptopyridine n-oxide \| BEW \| BRN 0109936 \| NSC 179790 \| 2-Pyridinethiol, 1-
Specifications & Purity	Moligand™, ≥96%
Biochemical and Physiological Mechanisms	Pyrithione, a Transition metal complexe, is a zinc ionophore that causes increased zinc levels within mammalian cells. Pyrithione has potent bactericidal and anti-fungal activity.
Storage Temp	Store at 2-8°C,Argon charged
Shipped In	Wet ice This product requires cold chain shipping. Ground and other economy services are not available.
Grade	Moligand™
Product Description	Pyrithione, a Transition metal complexe, is a zinc ionophore that causes increased zinc levels within mammalian cells. Pyrithione has potent bactericidal and anti-fungal activity.

Taxonomic Classification

Taxonomy Tree

Kingdom Organic compounds
- Superclass Organoheterocyclic compounds
  - Class Pyridines and derivatives
    - Subclass Hydropyridines

Kingdom	Organic compounds
Superclass	Organoheterocyclic compounds
Class	Pyridines and derivatives
Subclass	Hydropyridines
Intermediate Tree Nodes	Not available
Direct Parent	Dihydropyridines
Alternative Parents	Thiolactams Heteroaromatic compounds Azacyclic compounds Organosulfur compounds Organopnictogen compounds Organonitrogen compounds Organic oxygen compounds Hydrocarbon derivatives
Molecular Framework	Aromatic heteromonocyclic compounds
Substituents	Dihydropyridine - Heteroaromatic compound - Thiolactam - Azacycle - Organic nitrogen compound - Organic oxygen compound - Organopnictogen compound - Hydrocarbon derivative - Organosulfur compound - Organonitrogen compound - Aromatic heteromonocyclic compound
Description	This compound belongs to the class of organic compounds known as dihydropyridines. These are compounds containing a dihydropyridine moiety, which is a semi-saturated pyridine derivative with two double bonds.
External Descriptors	monohydroxypyridine - pyridinethione
1. Djoumbou Feunang Y, Eisner R, Knox C, Chepelev L, Hastings J, Owen G, Fahy E, Steinbeck C, Subramanian S, Bolton E, Greiner R, and Wishart DS. ClassyFire: Automated Chemical Classification With A Comprehensive, Computable Taxonomy. Journal of Cheminformatics, 2016, 8:61. DOI: 10.1186/s13321-016-0174-y

Names and Identifiers

IUPAC Name	1-hydroxypyridine-2-thione
INCHI	InChI=1S/C5H5NOS/c7-6-4-2-1-3-5(6)8/h1-4,7H
InChIKey	YBBJKCMMCRQZMA-UHFFFAOYSA-N
Smiles	C1=CC(=S)N(C=C1)O
Isomeric SMILES	C1=CC(=S)N(C=C1)O
Alternate CAS	1121-30-8,1121-31-9,15922-78-8 (hydrochloride salt)
NSC Number	179790
MeSH Entry Terms	1-hydroxypyridine-2-thione;2-HPT cpd;2-mercaptopyridine-N-oxide;2-pyridinethiol 1-oxide;67Ga-MPO;68Ga-mercaptopyridine-N-oxide;indium 111-2-mercaptopyridine-1-oxide;N-hydroxypyridine-2-thione;Omadine;pyridine-2-thiol N-oxide;pyrithione;pyrithione barium (
Molecular Weight	127.16
Reaxy-Rn	109936
Reaxys-RN_link_address	https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=109936&ln=

Certificates（CoA,COO,BSE/TSE and Analysis Chart)

C of A & Other Certificates(BSE/TSE, COO):

Analytical Chart:

Chemical and Physical Properties

Solubility	DMSO : 125 mg/mL (983.01 mM; Need ultrasonic)
Molecular Weight	127.170 g/mol
XLogP3	0.500
Hydrogen Bond Donor Count	1
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	0
Exact Mass	127.009 Da
Monoisotopic Mass	127.009 Da
Topological Polar Surface Area	55.600 Å²
Heavy Atom Count	8
Formal Charge	0
Complexity	162.000
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
The total count of all stereochemical bonds	0
Covalently-Bonded Unit Count	1

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