Disodium cyanodithiocarbamate | 138-93-2

• 分子结构分类: 有机化合物 - 有机盐 - 有机金属盐
• 英文名称: Disodium cyanodithiocarbamate
• 英文别名: disodium;cyanoiminomethanedithiolate
• CAS: 138-93-2
• 化学式: C2N2Na2S2
• 分子量: 162.15
• InChiKey: AZDIXEXNLJMBJO-UHFFFAOYSA-L

物化性质

• 沸点：
  109 °C
• 密度：
  1.2719E-3 g/cm3
• 溶解度：
  可微溶于水
• LogP：
  1.695 (est)
• 物理描述：
  Disodium cyanodithioimidocarbonate is a clear to orangish liquid with distinct odor. Irritates skin and eyes.
• 颜色/状态：
  Vivid orange/strong orange liquid
• 气味：
  Pungent, like ammonia
• 蒸汽压力：
  9.16X10-6 mm Hg @ 25 °C
• 稳定性/保质期：
  Stable for 14 days under the following conditions: ambient temperature (23 °C); broad spectrum light; stainless steel, copper metals and iron ions.
• 粘度：
  4.179 cSt
• 腐蚀性：
  No corrosion of packing material observed after 1 year.

计算性质

• 辛醇/水分配系数(LogP)：
  -6.07
• 重原子数：
  8
• 可旋转键数：
  0
• 环数：
  0.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  38.2
• 氢给体数：
  0
• 氢受体数：
  4

ADMET

毒理性

• 非人类毒性摘录

老鼠被给予了0、2、6或18毫克/千克/天的剂量。母体（基于18毫克/千克/天体重增加减少）和发育（基于相同最高测试剂量下骨骼变异增加）的无观察到效应水平（NOEL）都建立在中剂量，即6毫克/千克/天。因此，无法明确确定本研究所观察到的DCDIC的发育效果是否代表初级（直接胎儿）效应，或者这些效果是否是母体毒性的次级（间接）效应。

Rats were dosed with 0, 2, 6 or 18 mg/kg/day. Both maternal (based on decreased body weight gain at 18 mg/kg/day) and developmental (based on increased skeletal variants at the same highest dose tested) NOELs were established at the mid dose, 6 mg/kg/day. Hence there is no definitive determination as to whether the developmental effects of DCDIC as noted in this study represent a primary (direct fetal) effect, or if the effects are secondary (indirect) to maternal toxicity.

来源:Hazardous Substances Data Bank (HSDB)

毒理性

• 非人类毒性摘录

一个90天的皮肤研究（指南82-3）提供了足够的数据（MRID 40974801）。实验物质在剃光背部的大鼠身上涂抹了13周，剂量为0、25、125或250 mg/kg/天。在所有剂量的DCDIC（即，皮肤NOEL小于25 mg/kg/天）下观察到了皮肤刺激（红斑），但只有在125 mg/kg/天及以上的剂量下才注意到系统性影响（减少绝对和累积体重增加以及食物消耗）（即，系统性NOEL = 25 mg/kg/天）。在任何剂量下都没有观察到明显的内部器官影响。

Adequate data from a 90 day dermal study (guideline 82-3) are available (MRID 40974801). The test article was applied for 13 weeks to the shaved backs of Sprague Dawley rats at doses of 0, 25, 125 or 250 mg/kg/day. Dermal irritation (erythema) was observed at all doses of DCDIC (i.e., dermal NOEL was less than 25 mg/kg/day), but systemic effects (reduced absolute and cumulative body weight gain, and food consumption) were noted only at 125 mg/kg/day and above (i.e. systemic NOEL = 25 mg/kg/day). No gross internal organ effects were observed at any dose.

来源:Hazardous Substances Data Bank (HSDB)

毒理性

• 非人类毒性摘录

... 给兔子喂食0、3、10或30毫克/千克/天的剂量。基于中剂量测试（10毫克/千克/天）时活动减少、四肢病态和死亡的情况，母体效应的无观察效应水平（NOEL）和基于同一中剂量时增加吸收和减少窝仔数的发育效应的NOEL都是3毫克/千克/天，这是测试的最低剂量。... 测试的最高剂量，30毫克/千克/天，使没有活胎儿的母兔数量增加了50%，并且胚胎毒性更为严重，表现为活胎数减少，相应的吸收和着床后损失增加。

... Rabbits were dosed with 0, 3, 10 or 30 mg/kg/day. The NOEL for maternal effects (based upon decreased activity, limb morbidity & deaths at the mid dose tested, 10 mg/kg/day) & the NOEL for developmental effects (based upon increased resorption & decreased litter size at the same mid dose) were 3 mg/kg/day, the lowest dose tested. ... The highest dose tested, 30 mg/kg/day, produced a 50% incr in the number of does without viable fetuses, & more severe embryo toxicity, as manifested by decreased live litter size, with a corresponding incr in resorption & post-implantation loss.

来源:Hazardous Substances Data Bank (HSDB)

毒理性

• 非人类毒性摘录

基因突变测试在暴露于高达50-100微升/毫升的有毒浓度的沙门氏菌菌株中得到了阴性结果，无论是否进行活化处理。体外染色体损伤研究在激活（S9）的中国仓鼠细胞培养中，在非有毒剂量下，测试呈阳性，表明能诱导姐妹染色单体交换。DNA损伤/修复的体外研究在产生细胞毒性的浓度（损害细胞存活的浓度）下，对在大鼠原代肝细胞中诱导非计划DNA合成的作用被证明为阴性。

A gene mutation test ... had negative results in Salmonella strains exposed to toxic concns of up to 50-100 ul/ml, with/without activation. The chromosome damage in vitro study ... tested positive for inducing sister chromatid exchanges in activated (S9) cultures of Chinese hamster cells at non toxic doses, The DNA damage/repair in vitro study ... proved negative for inducing unscheduled DNA synthesis in primary rat hepatocytes at concns producing cytotoxicity (compromising cell survival).

来源:Hazardous Substances Data Bank (HSDB)

毒理性

• 非人类毒性摘录

嗜肺军团菌在自来水中的悬浮液被暴露于推荐用于抑制空调系统冷却塔和蒸发冷凝器中生物生长的生物杀灭剂中。氯、2,2-二溴-3-腈基丙酰胺以及含有二癸基二甲基铵盐和异丙醇的化合物能有效破坏每毫升10^5至10^6活细胞浓度的菌落。由5-氯-2-甲基-4-异噻唑啉-3-酮和2-甲基-4-异噻唑啉-3-酮、二钠亚乙基双(硫代碳酸酯)和二甲基二硫代碳酸钠以及含有五氯酚和其它氯酚钠盐的酚类配方效果较差。

Legionella pneumophila suspended in tap water was exposed to biocides recommended for inhibiting biological growth in cooling towers & evaporative condensers of air-conditioning systems. Chlorine, 2,2-dibromo-3-nitrilopropionamide, & a compound containing didecyldimethylammonium chloride & isopropanol were effective in destroying concns of 10(5)-10(6) viable cells/ml. Formulations consisting of 5-chloro-2-methyl-4-isothiazolin-3-one & 2-methyl-4-isothiazolin-3-one, disodium ethylene bis(thiocarbamate) & sodium dimethyl dithiocarbamate, & a phenolic with pentachlorophenate & sodium salts of other chlorophenols were less effective.

来源:Hazardous Substances Data Bank (HSDB)

反应信息

• 作为反应物：
  描述：

  Disodium cyanodithiocarbamate 、 硫化氢 生成 sodium;N-carbamothioylcarbamodithioate
  参考文献：
  名称：

  GATTOW G.; STURM B., Z. ANORG. UND ALLG. CHEM., 1980, 461, NO 2, 125-131

  摘要：

  DOI：
• 作为产物：
  描述：

  氰胺 、 二硫化碳 生成 Disodium cyanodithiocarbamate
  参考文献：
  名称：

  FISCHER, G. W.;PALLAS, M.;SCHNEIDER, P.;STEINKE, W.;THUST, U.;WALEK, W.;W+

  摘要：

  DOI：

文献信息

• FISCHER, G. W.;PALLAS, M.;SCHNEIDER, P.;STEINKE, W.;THUST, U.;WALEK, W.;W+
  作者：FISCHER, G. W.、PALLAS, M.、SCHNEIDER, P.、STEINKE, W.、THUST, U.、WALEK, W.、W+

  DOI：——

  日期：——
• GATTOW G.; STURM B., Z. ANORG. UND ALLG. CHEM., 1980, 461, NO 2, 125-131
  作者：GATTOW G.、 STURM B.

  DOI：——

  日期：——