摩熵化学
数据库官网
小程序
打开微信扫一扫
首页 分子通 化学资讯 化学百科 反应查询 关于我们
请输入关键词

2-methyl-2-(methylsulfonyl)propionaldehyde O-(methylcarbamoyl)oxime | 1646-88-4

中文名称
——
中文别名
——
英文名称
2-methyl-2-(methylsulfonyl)propionaldehyde O-(methylcarbamoyl)oxime
英文别名
Aldicarb sulfone;aldicarb-sulfone;aldicarbsulfon;aldoxycarb;2-Methyl-2-(methylsulfonyl)-propionaldehyd-O-(methylcarbamoyl)-oxim;[(E)-(2-methyl-2-methylsulfonylpropylidene)amino] N-methylcarbamate
2-methyl-2-(methylsulfonyl)propionaldehyde O-(methylcarbamoyl)oxime化学式
CAS
1646-88-4
化学式
C7H14N2O4S
mdl
——
分子量
222.265
InChiKey
YRRKLBAKDXSTNC-WEVVVXLNSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

物化性质

  • 熔点:
    132-135 °C
  • 密度:
    1.3816 (rough estimate)
  • 溶解度:
    可溶于DMSO(少许)、甲醇(少许)
  • 物理描述:
    Aldicarb sulfone is a white crystalline solid. Insecticide.
  • 蒸汽压力:
    9.00e-05 mmHg
  • 碰撞截面:
    151.43 Ų [M-H]-

计算性质

  • 辛醇/水分配系数(LogP):
    -0.6
  • 重原子数:
    14
  • 可旋转键数:
    4
  • 环数:
    0.0
  • sp3杂化的碳原子比例:
    0.71
  • 拓扑面积:
    93.2
  • 氢给体数:
    1
  • 氢受体数:
    5

ADMET

代谢
甲酰胺通过肝脏酶促水解;降解产物通过肾脏和肝脏排出。
The carbamates are hydrolyzed enzymatically by the liver; degradation products are excreted by the kidneys and the liver. (L793)
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 毒性总结
Aldoxycarb 是一种胆碱酯酶或乙酰胆碱酯酶(AChE)抑制剂。碳酸酯通过与酶的活性位点上的羧基化作用,形成不稳定的复合物与胆碱酯酶。这种抑制是可逆的。胆碱酯酶抑制剂抑制乙酰胆碱酯酶的作用。由于其基本功能,干扰乙酰胆碱酯酶作用的化学物质是强效的神经毒素,即使在低剂量下也会导致过度流涎和眼泪。在更高水平的暴露下,头痛、流涎、恶心、呕吐、腹痛和腹泻通常是显著的。乙酰胆碱酯酶分解在神经和肌肉接头释放的神经递质乙酰胆碱,以允许肌肉或器官放松。乙酰胆碱酯酶抑制的结果是乙酰胆碱积累并继续发挥作用,使得任何神经冲动不断传递,肌肉收缩不会停止。
Aldoxycarb is a cholinesterase or acetylcholinesterase (AChE) inhibitor. Carbamates form unstable complexes with chlolinesterases by carbamoylation of the active sites of the enzymes. This inhibition is reversible. A cholinesterase inhibitor suppresses the action of acetylcholine esterase. Because of its essential function, chemicals that interfere with the action of acetylcholine esterase are potent neurotoxins, causing excessive salivation and eye-watering in low doses. Headache, salivation, nausea, vomiting, abdominal pain and diarrhea are often prominent at higher levels of exposure. Acetylcholine esterase breaks down the neurotransmitter acetylcholine, which is released at nerve and muscle junctions, in order to allow the muscle or organ to relax. The result of acetylcholine esterase inhibition is that acetylcholine builds up and continues to act so that any nerve impulses are continually transmitted and muscle contractions do not stop.
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 致癌物分类
对人类不具有致癌性(未被国际癌症研究机构IARC列名)。
No indication of carcinogenicity to humans (not listed by IARC).
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 健康影响
急性暴露于胆碱酯酶抑制剂可能会导致胆碱能危象,表现为严重的恶心/呕吐、流涎、出汗、心动过缓、低血压、崩溃和抽搐。肌肉无力可能性增加,如果呼吸肌肉受累,可能导致死亡。在运动神经积累的乙酰胆碱会导致神经肌肉接头处烟碱表达的过度刺激。当这种情况发生时,可以看到肌肉无力、疲劳、肌肉痉挛、肌肉跳动和麻痹的症状。当自主神经节有乙酰胆碱积累时,这会导致交感系统中烟碱表达的过度刺激。与此相关的症状是高血压和低血糖。由于乙酰胆碱积累,中枢神经系统中烟碱乙酰胆碱受体的过度刺激会导致焦虑、头痛、抽搐、共济失调、呼吸和循环抑制、震颤、全身无力,甚至可能昏迷。当由于副交感神经节后纤维末端释放的乙酰胆碱过多而在毒蕈碱乙酰胆碱受体上表达毒蕈碱过度刺激时,可能会出现视力障碍、胸部紧绷、由于支气管收缩引起的喘息、支气管分泌物增加、唾液分泌增加、流泪、出汗、肠蠕动和排尿的症状。长期高(>10年)暴露会导致神经心理学后果,包括感知和视动处理障碍(A15321)。
Acute exposure to cholinesterase inhibitors can cause a cholinergic crisis characterized by severe nausea/vomiting, salivation, sweating, bradycardia, hypotension, collapse, and convulsions. Increasing muscle weakness is a possibility and may result in death if respiratory muscles are involved. Accumulation of ACh at motor nerves causes overstimulation of nicotinic expression at the neuromuscular junction. When this occurs symptoms such as muscle weakness, fatigue, muscle cramps, fasciculation, and paralysis can be seen. When there is an accumulation of ACh at autonomic ganglia this causes overstimulation of nicotinic expression in the sympathetic system. Symptoms associated with this are hypertension, and hypoglycemia. Overstimulation of nicotinic acetylcholine receptors in the central nervous system, due to accumulation of ACh, results in anxiety, headache, convulsions, ataxia, depression of respiration and circulation, tremor, general weakness, and potentially coma. When there is expression of muscarinic overstimulation due to excess acetylcholine at muscarinic acetylcholine receptors symptoms of visual disturbances, tightness in chest, wheezing due to bronchoconstriction, increased bronchial secretions, increased salivation, lacrimation, sweating, peristalsis, and urination can occur. Chronically high (>10 years) exposure leads to neuropsychological consequences including disturbances in perception and visuo-motor processing (A15321).
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 暴露途径
吸入 (L793);口服 (L793);皮肤给药 (L793)
Inhalation (L793) ; oral (L793); dermal (L793)
来源:Toxin and Toxin Target Database (T3DB)
毒理性
  • 症状
与有机磷化合物一样,症状和体征基于过度的胆碱能刺激。与有机磷中毒不同,氨基甲酸酯中毒的持续时间往往较短,因为神经组织乙酰胆碱酯酶的抑制作用是可逆的,且氨基甲酸酯的代谢速度更快。肌肉无力、眩晕、出汗和轻微的身体不适是常见的早期症状。头痛、流涎、恶心、呕吐、腹痛和腹泻在较高暴露水平时常常更为明显。瞳孔收缩伴视力模糊、不协调、肌肉抽搐和言语不清也有报道。(L795)
As with organophosphates, the signs and symptoms are based on excessive cholinergic stimulation. Unlike organophosphate poisoning, carbamate poisonings tend to be of shorter duration because the inhibition of nervous tissue acetylcholinesterase is reversible, and carbamates are more rapidly metabolized. Muscle weakness, dizziness, sweating and slight body discomfort are commonly reported early symptoms. Headache, salivation, nausea, vomiting, abdominal pain and diarrhea are often prominent at higher levels of exposure. Contraction of the pupils with blurred vision, incoordination, muscle twitching and slurred speech have been reported. (L795)
来源:Toxin and Toxin Target Database (T3DB)

安全信息

  • 危险等级:
    6.1(a)
  • 危险品标志:
    T+
  • 安全说明:
    S28,S36/37,S45
  • 危险类别码:
    R24,R26/28
  • WGK Germany:
    3
  • 危险品运输编号:
    UN 2757
  • RTECS号:
    UE2080000
  • 海关编码:
    2930909052
  • 包装等级:
    I
  • 危险类别:
    6.1(a)

SDS

SDS:1ca7d82f19844fafbadc155ee4caf656
查看

制备方法与用途

生物活性

Aldicarb sulfone(Temik sulfone)是一种氨基甲酸酯类杀虫剂,通过抑制胆碱酯酶来阻止突触乙酰胆碱的分解。

类别

  • 农药

毒性分级

  • 剧毒

急性毒性

  • 口服 - 大鼠 LD50: 20 毫克/公斤
  • 腹腔 - 小鼠 LD50: 21 毫克/公斤

可燃性危险特性

  • 易燃,燃烧时会产生刺激性烟雾

储运特性

  • 应存放在通风、低温和干燥的库房中,并与食品原料分开存放

灭火剂

  • 干粉、泡沫、砂土、二氧化碳或雾状水

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

点击查看最新优质反应信息

文献信息

  • [EN] ACC INHIBITORS AND USES THEREOF<br/>[FR] INHIBITEURS DE L'ACC ET UTILISATIONS ASSOCIÉES
    申请人:GILEAD APOLLO LLC
    公开号:WO2017075056A1
    公开(公告)日:2017-05-04
    The present invention provides compounds I and II useful as inhibitors of Acetyl CoA Carboxylase (ACC), compositions thereof, and methods of using the same.
    本发明提供了化合物I和II,这些化合物可用作乙酰辅酶A羧化酶(ACC)的抑制剂,以及它们的组合物和使用方法。
  • [EN] MICROBIOCIDAL OXADIAZOLE DERIVATIVES<br/>[FR] DÉRIVÉS D'OXADIAZOLE MICROBIOCIDES
    申请人:SYNGENTA PARTICIPATIONS AG
    公开号:WO2017157962A1
    公开(公告)日:2017-09-21
    Compounds of the formula (I) wherein the substituents are as defined in claim 1, useful as a pesticides, especially fungicides.
    式(I)的化合物,其中取代基如权利要求1所定义,作为杀虫剂特别是杀菌剂有用。
  • Thieno-pyrimidine compounds having fungicidal activity
    申请人:Brewster Kirkland William
    公开号:US20070093498A1
    公开(公告)日:2007-04-26
    The present invention relates to thieno[2,3-d]-pyrimidine compounds having fungicidal activity.
    本发明涉及具有杀真菌活性的噻吩[2,3-d]-嘧啶化合物。
  • [EN] INSECTICIDAL TRIAZINONE DERIVATIVES<br/>[FR] DÉRIVÉS DE TRIAZINONE INSECTICIDES
    申请人:SYNGENTA PARTICIPATIONS AG
    公开号:WO2013079350A1
    公开(公告)日:2013-06-06
    Compounds of the formula (I) or (I'), wherein the substituents are as defined in claim 1, are useful as pesticides.
    式(I)或(I')的化合物,其中取代基如权利要求1所定义的那样,可用作杀虫剂。
  • THIENYLPYRIDYLCARBOXAMIDES
    申请人:Dunkel Ralf
    公开号:US20110105564A1
    公开(公告)日:2011-05-05
    Novel thienylpyridylcarboxamides of the formula (I) The present application is also directed to a plurality of processes for preparing these compounds and their use for controlling unwanted microorganisms, and also novel intermediates and their preparation.
    新型噻吩基吡啶基羧酰胺的化学式(I) 本申请还涉及多种制备这些化合物的方法,以及它们用于控制不受欢迎的微生物的用途,还有新颖的中间体及其制备。
查看更多