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Zinc Pyrithione

CAS: 13463-41-7 | C10H8N2O2S2Zn

2D Structure

3D Structure

Loading 3D structure...

Basic Information

CAS Registry Number: 13463-41-7
Molecular Formula: C10H8N2O2S2Zn

Names and Synonyms:

Zinc Pyrithione
Zincopan
Zinc, bis[1-(hydroxy-κO)-2(1H)-pyridinethionato-κS2]-, (T-4)-
Zinc, bis(1-hydroxy-2(1H)-pyridinethionato)-
Zinc, bis(1-hydroxy-2(1H)-pyridinethionato-O,S)-, (T-4)-
2(1H)-Pyridinethione, 1-hydroxy-, zinc complex
(T-4)-Bis[1-(hydroxy-κO)-2(1H)-pyridinethionato-κS2]zinc
Zinc pyrithione
Omadine Zinc
Pyrithione zinc
Bis(1-hydroxy-2-(1H)-pyridinethionato)zinc
Zinc, bis(2-pyridinylthio)-, N,N′-dioxide
Zinc 2-pyridinethiol 1-oxide
Vancide P
Zinc Omadine
ZPT
OM 1563
2-Mercaptopyridine 1-oxide zinc salt
Zinc 1-hydroxy-2-pyridinethione
2-Pyridinethiol 1-oxide zinc salt
Zinc pyrethion
2-Pyridinethiol N-oxide zinc salt
Zincpolyanemine
Zinc 2-mercaptopyridine N-oxide
Zinc pyridine-2-thione-N-oxide
FSB 8332
1-Hydroxy-2-pyridinethione, zinc salt
Evafine P 50
Tomicide Z 50
Bis(1-hydroxy-2(1H)-pyridinethionato)zinc
Hokucide ZPT
Finecide ZPT
Biocut ZP
Bis(2-pyridinethiol 1-oxide)zinc
BC-J
Tomicide ZPT 50
Niccanon SKT
Niccanon ZP
Marukacide YP-DP
Zinc bis(2-pyridylthio-1-oxide)
Sebulon Shampoo
Desquaman
Danex
ZNP Bar
Tomicide ZPT
NSC 290409
AF-Z
Tomicide ZPT 100
Zinc Pyrion
2-Pyridylthiol-1-oxide zinc salt
Microban Additive ZO 1
ZO-E
Zn Omadine ZOE
Microban Z 01
Sanitized TH 22-27
Clean-Bio ZP
Sanaizol 200
Dantrol
Sanitized TH 27-24BT
Slaoff 95
Slaoff 94
Vedexil-PZ
Hybricide 89
Denistat ANK
ZOE-T
Intercide ZNP
SR-A 103
ZnPT
Zinc Omadine ZOE Dispersion
Zinc Omadine ZOE
TH 22-27
Zinc bis(2-mercaptopyridine-N-oxide)
Zinc Omacide ZOE
FK-C
RUCO-BAC ZPY

Identifiers:

SMILES:
[O-]n1ccccc1=S.[O-]n1ccccc1=S.[Zn+2]
InChI:
InChI=1S/2C5H4NOS.Zn/c2*7-6-4-2-1-3-5(6)8;/h2*1-4H;/q2*-1;+2

Spectral Data

NMR, IR, and Mass spectral data

1H NMR
13C NMR
Predicting NMR spectra...
10 ppm 9 8 7 6 5 4 3 2 1 0 ppm
Shift (ppm) Multiplicity Integration Assignment
200 ppm 180 160 140 120 100 80 60 40 20 0 ppm
Shift (ppm) DEPT Assignment

Note: These NMR spectra are predicted computationally and may differ from experimental data. Predictions are based on chemical environment analysis.

External Resources

All Properties

Comprehensive physical and chemical properties

Property Value Source
Physical Properties 317.71 g/mol Legacy Database
1.78 g/cm³ Legacy Database
https://en.wikipedia.org/wiki/Zinc_pyrithione Legacy Database
[O-]1N2C=CC=CC2=[S][Zn+2]13[O-]N4C=CC=CC4=[S]3 Legacy Database
1.782 g/cm3 @ Temp: 25 °C Legacy Database
InChI=1S/2C5H4NOS.Zn/c2*7-6-4-2-1-3-5(6)8;/h2*1-4H;/q2*-1;+2 Legacy Database
InChIKey=PICXIOQBANWBIZ-UHFFFAOYSA-N Legacy Database
240 °C (decomp) Legacy Database
Pyrithione zinc Legacy Database
Zinc pyrithione Legacy Database
3.124480000000001 RDKit
Molecular 317.71000000000004 g/mol RDKit
Exact 315.931861696 g/mol RDKit
Heavy 17 count RDKit
Hydrogen 6 count RDKit
0 count RDKit
Rotatable 0 count RDKit
Aromatic 2 count RDKit
Topological 55.98 Ų RDKit
Molar 68.06200000000003 RDKit

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