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| CAS No.: | 117-97-5 |
|---|---|
| Name: | PENTACHLOROBENZENETHIOL ZINC SALT |
| Molecular Structure: | |
|
|
|
| Formula: | C6H Cl5 S . 1/2 Zn |
| Molecular Weight: | 628.184 |
| Synonyms: | Benzenethiol,pentachloro-, Zn deriv. (6CI);Benzenethiol, pentachloro-, zinc salt (8CI,9CI);Zinc, bis[(pentachlorophenyl)thio]- (7CI);Dansof Z;Endor;Pentachlorobenzenethiol zinc salt;Pentachlorothiophenol zinc salt;Renacit 4;Renacit IV;Reptazin Zn;Saginol;Zinc Pentachlorothiophenol;Zincpentachlorothiophenate;Zinc pentachlorothiophenolate; |
| EINECS: | 204-224-1 |
| Density: | g/cm3 |
| Melting Point: | 364-369 °C (dec.)(lit.) |
| Boiling Point: | 351.3 °C at 760 mmHg |
| Flash Point: | 144.6 °C |
| Appearance: | White-like powder |
| Hazard Symbols: |
 C
|
| Risk Codes: | 34 |
| Safety: | A severe eye and skin irritant. See also ZINC COMPOUNDS and CHLORINATED HYDROCARBONS, AROMATIC. When heated to decomposition it emits very toxic fumes of ZnO, Cl− and SOx. |
| Transport Information: | UN 1759 8 |
| PSA: | 50.60000 |
| LogP: | 11.01750 |
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Chemistry
Molecular Formula: C12Cl10S2Zn
Molar mass: 628.18 g/mol
EINECS: 204-224-1
Flash Point: 144.6 °C
Boiling Point: 351.3 °C at 760 mmHg
Vapour Pressure: 8.41E-05 mmHg at 25°C
Melting point: 364-369 °C (dec.)(lit.)
Storage temp: Store at 0-5°C
Freezing Point: -4 °F
Water solubility: Insoluble
Sensitive: Air & Light Sensitive
Appearance: Yellow or tan powder
Solubility: Soluble in ethanol, methanol, chloroform, insoluble in acetone, water, benzene, almost insoluble in carbon tetrachloride
Product categories of Bis((pentachlorophenyl)thio), zinc salt (117-97-5): Organic-metal salt;Chemical Synthesis;Catalysis and Inorganic Chemistry
Structure of Bis((pentachlorophenyl)thio), zinc salt (117-97-5):
H-Bond Donor: 0
H-Bond Acceptor: 2
Systematic Name: Zinc 2,3,4,5,6-pentachlorobenzenethiolate
SMILES: [Zn+2].Clc1c([S-])c(Cl)c(Cl)c(Cl)c1Cl.Clc1c(Cl)c([S-])c(Cl)c(Cl)c1Cl
InChI: InChI=1/2C6HCl5S.Zn/c2*7-1-2(8)4(10)6(12)5(11)3(1)9;/h2*12H;/q;;+2/p-2
InChIKey: ONSIBMFFLJKTPT-NUQVWONBAK
Std. InChI: InChI=1S/2C6HCl5S.Zn/c2*7-1-2(8)4(10)6(12)5(11)3(1)9;/h2*12H;/q;;+2/p-2
Std. InChIKey: ONSIBMFFLJKTPT-UHFFFAOYSA-L
Uses
Bis((pentachlorophenyl)thio), zinc salt (117-97-5) can be used as a rubber peptizer.
Toxicity Data With Reference
| 1. | skn-rbt 500 mg/24H SEV | 28ZPAK Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku Marhold, J.V.,Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha,Czechoslovakia.: 1972,11. | ||
| 2. | eye-rbt 250 µg/24H SEV | 28ZPAK Sbornik Vysledku Toxixologickeho Vysetreni Latek A Pripravku Marhold, J.V.,Institut Pro Vychovu Vedoucicn Pracovniku Chemickeho Prumyclu Praha,Czechoslovakia.: 1972,11. |
Consensus Reports
Reported in EPA TSCA Inventory. Zinc and its compounds are on the Community Right-To-Know List.
Safety Profile
A severe eye and skin irritant. See also ZINC COMPOUNDS and CHLORINATED HYDROCARBONS, AROMATIC. When heated to decomposition it emits very toxic fumes of ZnO, Cl− and SOx.
Hazard Codes: C.gif){kind=small}
Risk Statements:
34: Causes burns
Safety Statements:
22: Do not breathe dust
26: In case of contact with eyes, rinse immediately with plenty of water and seek medical advice
36: Wear suitable protective clothing
37: Wear suitable gloves
39: Wear eye/face protection
45: In case of accident or if you feel unwell, seek medical advice immediately (show label where possible)
Specification
Bis((pentachlorophenyl)thio), zinc salt (117-97-5) also can be called Zinc bis(pentachlorothiophenolate) ; Pentachlorothioiphenol zinc salt ; Zinc pentachlorothiophenolate ; Zinc 2,3,4,5,6-pentachlorobenzenethiolate .