나트륨 디에틸디티오카르밤산 염
나트륨다이에틸다이싸이오카밤산염 · 나트륨디에틸디티오카르밤산염 · 나트륨디에틸디티오카르바메이트 · DDTC · DTC · dithiocarbamate · dedc · NADEDC

식별자 및 물리적 특성
| CAS No. | 148-18-5 |
|---|---|
| 분자식 | (C2H5)2NCS2Na |
| 평균 분자량 | 171.3 g/mol |
| 단동위원소 질량 | 171.0152356 g/mol |
| SMILES | CCN(CC)C(=S)[S-].[Na+] |
| InChIKey | IOEJYZSZYUROLN-UHFFFAOYSA-M |
| PubChem CID | 533728 |
| ChEMBL | CHEMBL107217 |
| ChEBI | CHEBI:82587 |
| EC No. | 205-710-6 |
| DTXSID | DTXSID3022956 |
| 현지명 | 나트륨 디에틸디티오카르밤산 염 |
화학 및 물리적 성질
| 극성 표면적 | 36.3 |
|---|---|
| 수소 결합 공여자 수 | 0 |
| 수소 결합 수용자 수 | 2 |
| 회전 가능 결합 수 | 2 |
| 무거운 원자 수 | 9 |
| 형식 전하 | 0 |
| 복잡도 | 83 |
| Polymers | Plastics & Rubber -> Dithiocarbamates (Rubber) |
| 농약 | Pesticide -> EPA IRIS |
| LogP(분배 계수) | log Kow <1.10 |
| 밀도 | 1.1 at 68 °F (NTP, 1992) - Denser than waterwill sink1.1 g/cu cm at 20 °C/20 °CRelative density (water = 1): 1.11.1 @ 20°C1.1000 |
| Color/Form | Crystals from ethanolYellow to green liquid at 20 °C and 1013 hPa (solution in water) |
| 용해도 | greater than or equal to 100 mg/mL at 57 °F (NTP, 1992)Soluble in waterSoluble in alcoholSolubility in water: solubleabout 35 % in water, less soluble in organic solvents. However, the free acid, diethyldithiocarbamic acid, is readily soluble in organic solvents and less soluble in water. Thus, on acidification of an aqueous solution of a diethyldithiocarbamate, the free acid can be extracted with chloroform or carbon tetrachloride. The distribution ratio is 2,360 for chloroform and 343 for carbon tetrachloride. |
| Decomposition | When heated to decomposition it emits very toxic fumes of /nitrogen, sulfur, and sodium oxides/. |
| 녹는점 | 203 °F (NTP, 1992)95 °C90-102 °C95°C |
| 증기 밀도 | 5.9 (NTP, 1992) - Heavier than airwill sink (Relative to Air)5.9 (Air = 1)Relative vapor density (air = 1): 5.9 |
| Physical Description | Sodium diethyldithiocarbamate appears as odorless white or slightly brown or slightly pink crystals. (NTP, 1992)[ICSC]WHITE CRYSTALS. |
| Stability/Shelf Life | Stable under recommended storage conditions. /Sodium diethyldithiocarbamate trihydrate/Aqueous solutions decompose slowly. |
| Other Experimental Properties | AQUEOUS SOLN IS ALKALINE TO LITMUS & PHENOLPHTHALEINSolubility in water = 2.9X10+4mg/Llog Kow = 1.67VP: 0.121 mm HgHenry's Law constant = 6.84X10-4 atm-cu m/molHydroxyl radical reaction rate constant = 2.0X10-10 cu cm/molecule-sec (all estimated at 25 °C) /Ditiocarb/Thin, irregular plate-like crystals from acetone, mp 94-102 °C. Also reported as 90-92 °C. Freely soluble in watersoluble in ethanol, methanol, acetone. Insoluble in ether, benzene. The aqueous solution is alkaline to litmus and phenolphthalein and slowly decomposes. (pH of 10% aqueous solution is 11.6 at room temperature). The addition of an acid to the aqueous solution produces a white turbidity due to the liberation of carbon disulfide. UV max (ethanol): 257, 290 nm (epsilon 1200, 1300) /Sodium diethyldithiocarbamate trihydrate/Greenish-yellow liquid with a characteristic smell comprising a 23% solution in water |
| 증기압 | 0Pa at 20℃ |
| 저장 조건 | Keep in dark place,Inert atmosphere,Room temperature |
| pKa(산도 계수) | 3.3 |
| 물리적 상태 | 액체 |
| 색상 | 투명, 무색 |
| 비중 | 1.08 |
| 냄새 | 흰색, 약간.갈색 또는 약간 분홍색의 무취 결정. |
| 용해도 | 14 ºC에서 >=10g/100 mL |
| LogP(분배 계수) | -1.1 at 20℃ |
| EPA | Sodium diethyldithiocarbamate (148-18-5) |
화학적 성질
Sodium diethyldithiocarbamate is a white or colorless crystalline powder, easily soluble in water and alkaline, soluble in alcohol, rapidly decomposed in acidic aqueous solution to separate out carbon disulfide and make the solution cloudy. In ammonia medium, it generates precipitate or brown colloidal solution with copper ion. Copper reagent is applied in the color development reaction of copper, used as precipitant and solvent extractant of soft metal ions, also used as photometric reagent for the determination of bismuth, copper, nickel and other metals.
안전 및 규제
| GHS 분류 | WarningH302 (71.2%): Harmful if swallowed [Warning Acute toxicity, oral]P261, P264, P264+P265, P270, P271, P273, P280, P301+P317, P302+P352, P304+P340, P305+P351+P338, P319, P321, P330, P332+P317, P337+P317, P362+P364, P391, P403+P233, P405, and P501 (click each P-code to see the statement)Aggregated GHS information provided per 66 reports by companies from 10 notifications to the ECHA C&L Inventory. Each notification may be associated with multiple companies.H302: Harmful if swallowed [Warning Acute toxicity, oral] |
|---|---|
| 규제 정보 | Chemical: Carbamodithioic acid, diethyl-, sodium saltStatus: Active Update: 30-08-2022 https://echa.europa.eu/registration-dossier/-/registered-dossier/11278Sodium diethyldithiocarbamate: Does not have an individual approval but may be used under an appropriate group standard |
| 운송 라벨(DOT) | Class 9 |
| 화재 위험 | Flash point data for this chemical are not availablehowever, it is probably combustible. (NTP, 1992)Combustible. Gives off irritating or toxic fumes (or gases) in a fire. |
| 건강 유해성 | SYMPTOMS: Symptoms of exposure to this chemical include irritation of the eyes. Continued exposure may cause mild skin irritation. The dusts of this compound are caustic to the mucous membranes. This compound is also caustic to the digestive tract. |
| 유해성 요약 | Symptoms of exposure to this chemical include irritation of the eyes. Continued exposure may cause mild skin irritation. The dusts of this compound are caustic to the mucous membranes. This compound is also caustic to the digestive tract. [CAMEO] Danger of sensitization of the skin[MAK] See Carba mix. |
| 반응성 그룹 | Thiocarbamate Esters and Salts/Dithiocarbamate Esters and Salts |
| UN 분류 | UN Hazard Class: 9UN Pack Group: III |
| Special Reports | DHEW/NCIBioassay of Sodium Diethyldithiocarbamate for Possible Carcinogenicity (1979) Technical Rpt Series No. 172 DHEW Pub No. (NIH) 79-1728 |
| Reactivity Profile | SODIUM DIETHYLDITHIOCARBAMATE is not compatible with strong oxidizing agents. Aqueous solutions slowly decompose to form carbon disulfide and an amine. Such decompositions are accelerated by acids. Addition of acid to the aqueous solution produces a white turbidity (NTP, 1992). |
용도
용도
Sodium diethyldithiocarbamate is an organic molecular entity. It is an inhibitor of superoxide dismutase, having both antioxidant and oxidant effects.
일반 설명
Odorless white or slightly brown or slightly pink crystals.
제조 및 합성 방법
제조 방법
This salt is obtained by treating carbon disulfide with diethylamine in the presence of sodium hydroxide:CS2+ HN(C2H5)2+ NaOH → NaS2CN(C2H5)2+ H2O