Pyrithione Zinc
ZPT · Pyrithione zinc · ZNPT · 1-HYDROXYPYRIDINE-2-THIONE ZINC · Bis[[(pyridine 1-oxide)-2-yl]thio] zinc salt · zincomadine · 2-MERCAPTOPYRIDINE N-OXIDE ZINC SALT · 1-HYDROXYPYRIDINE-2-THIONE ZINC SALT

Identifiers & Physical Properties
| CAS No. | 13463-41-7 |
|---|---|
| Molecular formula | C10H8N2O2S2Zn |
| Average molar mass | 317.7 g/mol |
| Monoisotopic mass | 315.931862 g/mol |
| SMILES | [O-][n+]1ccccc1[S-].[O-][n+]1ccccc1[S-].[Zn+2] |
| InChIKey | OTPSWLRZXRHDNX-UHFFFAOYSA-L |
| PubChem CID | 26041 |
| ChEMBL | CHEMBL1200471 |
| EC No. | 236-671-3 |
Chemical & Physical Properties
| Topological polar surface area | 52.9 |
|---|---|
| Hydrogen bond donors | 0 |
| Hydrogen bond acceptors | 4 |
| Rotatable bonds | 2 |
| Heavy atoms | 17 |
| Formal charge | 0 |
| Complexity | 183 |
| Cosmetics | Cosmetics ingredient -> Conditioning/EmollientOther (Specify)PreservativeAntiseborrhoeic |
| Odor | MildMild Characteristic |
| Density | 1.782 at 25 °CBulk density: 0.35particle size: 80 to less than 20 u1.782 g/cm3(Temp: 25 °C) |
| Color/Form | Off-white powder |
| Solubility | Insoluble (<1 mg/ml at 70 °F) (NTP, 1992)almost transparency in PyridineInsoluble (<0.1 g/100 mL at 21 ºC) |
| Human Drugs | FDA approved drugs -> Active ingredient |
| Decomposition | When heated to decomposition it emits very toxic fumes of /nitrogen oxides, sulfur oxides, and zinc oxide/. |
| Melting point | 240 °C, decomposesapproximate 240℃ |
| Food Contact Substances | FCS -> FDA Inventory of Effective Food Contact Substance (FCS) Notifications |
| Physical Description | Zinc pyrithione is a fine beige granules. (NTP, 1992)Wet SolidDry Powder |
| Stability/Shelf Life | Stable at 100 °C for 120 hr |
| Vapor pressure | 0Pa at 25℃ |
| Storage conditions | Sealed in dry,Room Temperature |
| Physical state | Powder |
| Color | White to Orange to Green |
| Merck | 14,7994 |
| Cosmetics Ingredients Functions | PRESERVATIVEHAIR CONDITIONINGANTI-SEBORRHEICANTI-SEBUM |
| InChI | InChI=1S/2C5H5NOS.Zn/c2*7-6-4-2-1-3-5(6)8/h2*1-4,8H/q+2/p-2 |
| InChIKey | OTPSWLRZXRHDNX-UHFFFAOYSA-L |
| SMILES | C1(C=CC=C[N+]=1[O-])S[Zn]SC1C=CC=C[N+]=1[O-] |
| LogP (partition coefficient) | 0.9 at 25℃ and pH7.5-7.7 |
| Surface tension | 73mN/m at 7.22mg/L and 20℃ |
| CAS DataBase Reference | 13463-41-7(CAS DataBase Reference) |
| EWG's Food Scores | 2-3 |
| FDA UNII | R953O2RHZ5 |
| ATC code | D11AX12 |
| EPA Substance Registry System | Zinc pyrithione (13463-41-7) |
| UNSPSC Code | 41116107 |
| NACRES | NA.24 |
| GHS pictogram | GHS05,GHS06,GHS08,GHS09 |
| Signal word | Danger |
| GHS hazard statements | H301-H318-H330-H360D-H372-H410 |
| GHS precautionary statements | P202-P260-P273-P280-P304+P340+P310-P305+P351+P338 |
| Personal protective equipment (PPE) | Eyeshields, Faceshields, Gloves, type P3 (EN 143) respirator cartridges |
| Hazard symbols | T+,N,T |
| Risk statements (R) | 24/25-26-37/38-41-50/53-23-22 |
| Safety statements (S) | 26-28-36/37/39-45-61-60-39 |
| UN transport number | UN 2811 6.1/PG 2 |
| Water hazard class (WGK) | 3 |
| RTECS number | ZH0950000 |
| TSCA inventory status | TSCA listed |
| Hazard class | 6.1(b)Acute Tox. 2 InhalationAcute Tox. 3 OralAquatic Acute 1Aquatic Chronic 1Eye Dam. 1Repr. 1BSTOT RE 1 |
| Packing group | III |
| Customs code | 29333990 |
| Storage class | 6.1A - Combustible acute toxic Cat. 1 and 2very toxic hazardous materials |
| Hazardous substances data | 13463-41-7(Hazardous Substances Data) |
| Toxicity | LD50 oral in rat: 177mg/kg |
| REACH registrations | Active |
Safety & Regulations
| GHS classification | DangerH301: Toxic if swallowed [Danger Acute toxicity, oral]P203, P260, P264, P264+P265, P270, P271, P273, P280, P284, P301+P316, P304+P340, P305+P354+P338, P316, P317, P318, P319, P320, P321, P330, P391, P403+P233, P405, and P501 (click each P-code to see the statement)This chemical does not meet GHS hazard criteria for 0.4% (5 of 1321) of reports.H301 (83.2%): Toxic if swallowed [Danger Acute toxicity, oral] |
|---|---|
| Regulatory information | Chemical: Zinc, bis(1-hydroxy-2(1H)-pyridinethionato-O,S)-, (T-4)-Hazard Traits - Reproductive ToxicityZinc, bis[1-(hydroxy-.kappa.O)-2(1H)-pyridinethionato-.kappa.S2]-, (T-4)- is listed on the EPA's Chemical Data Reporting (CDR) system. Manufacturers and importers of Zinc, bis[1-(hydroxy-.kappa.O)-2(1H)-pyridinethionato-.kappa.S2]-, (T-4)- are required to report information about their production and use of this chemical to the EPA under the Toxic Substances Control Act (TSCA). (40 eCFR Part 711)REACH registered substance: Pyrithione zinc (EC: 236-671-3)Zinc pyrithione: Does not have an individual approval but may be used under an appropriate group standard |
| Other safety information | IMAP assessments - Zinc, bis(1-hydroxy-2(1H)-pyridinethionato-O,S)-, (T-4)-: Human health tier II assessment |
| DOT label | Poison |
| Fire hazards | Flash point data for this chemical are not available, but it is probably combustible. (NTP, 1992) |
| Health hazards | SYMPTOMS: Skin and eye irritation. |
| Reactive group | Salts, Basic |
| Special Reports | Wedig JH, Henderson RToxicology Profile Of The Antimicrobial Zinc Bis(1-Hydroxy-2-(1H-Pyridinethionate))Hair Res (Proc Int Congr) 1st: 565 (1981). A review with 17 references. In several studies, Zinc Bis(1-Hydroxy-2-(1H-Pyridinethionate) showed little toxicity. |
| FIFRA requirements | As the federal pesticide law FIFRA directs, EPA is conducting a comprehensive review of older pesticides to consider their health and environmental effects and make decisions about their continued use. Under this pesticide reregistration program, EPA examines newer health and safety data for pesticide active ingredients initially registered before November 1, 1984, and determines whether the use of the pesticide does not pose unreasonable risk in accordance to newer saftey standards, such as those described in the Food Quality Protection Act of 1996. Pesticides for which EPA had not issued Registration Standards prior to the effective date of FIFRA '88 were divided into three lists based upon their potential for human exposure and other factors, with List B containing pesticides of greater concern than those on List C, and with List C containing pesticides of greater concern than those on List D. Zinc 2-pyridinethiol-1-oxide is found on List B. Case No: 2480 |
Applications & Uses
Uses
Shampoo for dandruff,zinc pyrithione can inhibit Gram positive and negative bacteria and mold growth,Care hair Effectively , delay hair aging ,control white hair and hair loss generation. zinc pyrithion is also used as a cosmetic preservative, oil, paint biocide. Zinc pyrithione has a strong killing power on fungi and bacteria so that it can effectively kill dandruff fungus,playing a role in dandruff .
Description
Zinc pyrithione is a coordination complex of zinc and pyrithione that has antimicrobial and anticancer activities. It is active against the bacteria E. coli, S. aureus, K. pneumoniae, A. baumannii, P. aeruginosa, E. faecium, E. faecalis, and E. cloacae (MICs = 1-4 μg/ml) and the fungus P. ovale when used at concentrations ranging from 0.01 to 10 μg/ml. Zinc pyrithione reduces tumor growth in an SCC-4 mouse xenograft model when administered at a dose of 1 mg/kg per week for six weeks. Formulations containing zinc pyrithione have been used in the treatment of dandruff.
Uses
zinc pyrithione is a preservative against bacteria, fungi, and yeast. It is unstable in light and in the presence of oxidizing agents. Zinc pyrithione is useful in gels, creams, heavy lotions, and talcum powder.
Uses
Reactions may lead to photosensitive eczema and actinic reticuloid syndrome. Zinc pyrithione is used as antifungal, antibacterial and antiseborrheic agent used in many shampoos and hair creams.
Uses
Zinc pyrithione is directly cytotoxic and has antimicrobial effects. Zinc pyrithione is found in many shampoos (DHS-Zinc, Head and Shoulders) and should be applied for 5 minutes daily for 2 weeks. Zinc pyrithione is the active ingredient in several shampoos used to control dandruff and seborrheic dermatitis and is also effective in the therapy of tinea versicolor. It remains unclear whether the beneficial effects are caused by an antiproliferative or antimicrobial effect or both. It is substantive to the hair, allowing continued therapeutic effect after washing.
General Description
Fine beige granules.