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| CAS No.: | 36551-21-0 |
|---|---|
| Name: | sodium O-sec-butyl dithiocarbonate |
| Article Data: | 1 |
| Molecular Structure: | |
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| Formula: | C5H10 O S2 . Na |
| Molecular Weight: | 172.248 |
| Synonyms: | Carbonodithioicacid, O-(1-methylpropyl) ester, sodium salt (9CI); Xanthic acid, sec-butyl-,sodium salt (6CI); Sodium sec-butyl xanthate |
| Density: | g/cm3 |
| Boiling Point: | 161.8°Cat760mmHg |
| Flash Point: | 51.7°C |
| Safety: | Poison by parenteral route. Moderately toxic by intraperitoneal route. When heated to decomposition it emits toxic fumes of SOx and Na2O. See also ESTERS. |
| PSA: | 41.32000 |
| LogP: | 1.63330 |
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Chemistry
Empirical Formula of Sodium sec-butyl xanthate (CAS NO.36551-21-0): C5H9NaOS2
Molecular Weight: 172.2441
EINECS: 253-097-9
Flash Point: 51.7 °C
Enthalpy of Vaporization: 38.2 kJ/mol
Boiling Point: 161.8 °C at 760 mmHg
Vapour Pressure: 2.91 mmHg at 25 °C
Structure of Sodium sec-butyl xanthate (CAS NO.36551-21-0):
IUPAC Name: Sodium butan-2-yloxymethanedithioate
Canonical SMILES: CCC(C)OC(=S)[S-].[Na+]
InChI: InChI=1S/C5H10OS2.Na/c1-3-4(2)6-5(7)8;/h4H,3H2,1-2H3,(H,7,8);/q;+1/p-1
InChIKey: LRHOHFCSKBRDFH-UHFFFAOYSA-M
Toxicity Data With Reference
| 1. | ipr-mus LDLo:500 mg/kg | CBCCT* “Summary Tables of Biological Tests” National Research Council Chemical-Biological Coordination Center. 6 (1954),230. | ||
| 2. | par-mus LDLo:400 mg/kg | CBCCT* “Summary Tables of Biological Tests” National Research Council Chemical-Biological Coordination Center. 7 (1955),696. |
Consensus Reports
Reported in EPA TSCA Inventory.
Safety Profile
Poison by parenteral route. Moderately toxic by intraperitoneal route. When heated to decomposition Sodium sec-butyl xanthate (CAS NO.36551-21-0) emits toxic fumes of SOx and Na2O. See also ESTERS.
Specification
Sodium sec-butyl xanthate , its cas register number is 36551-21-0. It also can be called sek.Butylxanthogenan sodny ; Xanthic acid, sec-butyl-, sodium salt ; Natrium-O-1-methylpropyldithiokarbonat ; and Carbonic acid, dithio-, O-sec-butyl ester, sodium salt .