2-chloro-5-nitro-N-(n-propyl)benzamide | 130674-22-5

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 英文名称: 2-chloro-5-nitro-N-(n-propyl)benzamide
• 英文别名: 2-chloro-5-nitro-benzoic acid propylamide；2-Chlor-5-nitro-benzoesaeure-propylamid；2-chloro-5-nitro-N-propylbenzamide
• CAS: 130674-22-5
• 化学式: C₁₀H₁₁ClN₂O₃
• mdl: MFCD01215242
• 分子量: 242.662
• InChiKey: MMLVIEFQUVREDB-UHFFFAOYSA-N

物化性质

• 熔点：
  148-150 °C(Solv: ethanol (64-17-5))
• 沸点：
  365.3±32.0 °C(Predicted)
• 密度：
  1.300±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  16
• 可旋转键数：
  3
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  74.9
• 氢给体数：
  1
• 氢受体数：
  3

反应信息

• 作为反应物：
  描述：

  2-chloro-5-nitro-N-(n-propyl)benzamide 、 正丁胺 以 甲醇 为溶剂， 反应 10.0h， 以62%的产率得到2-(butylamino)-5-nitro-N-propylbenzamide
  参考文献：
  名称：

  Shinde; Shenoy; Pai, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 8, p. 711 - 720

  摘要：

  DOI：
• 作为产物：
  描述：

  2-氯-5-硝基苯甲酸 在 氯化亚砜 、 碳酸氢钠 作用下， 以 二氯甲烷 、 水 为溶剂， 反应 3.0h， 生成 2-chloro-5-nitro-N-(n-propyl)benzamide
  参考文献：
  名称：

  Shinde; Shenoy; Pai, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 8, p. 711 - 720

  摘要：

  DOI：

文献信息

• One Pot Regioselective Synthesis of a Small Library of Dibenzo[<i>b</i>,<i>f</i>][1,4]thiazepin-11(10<i>H</i>)-ones via Smiles Rearrangement
  作者：Yongmei Zhao、Qiaoling Dai、Zhi Chen、Qihui Zhang、Yongcheng Bai、Chen Ma

  DOI：10.1021/co300139s

  日期：2013.2.11

  A facile and efficient method has been developed for the synthesis of a small library of dibenzo[b,f][1,4]thiazepin-11(10H)-ones via Smiles rearrangement. Compounds were obtained in excellent isolated yields (70%–92%) under metal-free conditions. More specifically, this transition metal-free process relates to an environmentally friendly, economical, and efficient method for preparing benzoic-fused

  已经开发了一种通过Smiles重排合成小的二苯并[ b，f ] [1,4] thiazepin-11（10 H）-ones小型文库的简便有效方法。在无金属条件下，化合物的分离产率极高（70％–92％）。更具体地说，这种无过渡金属的方法涉及制备苯并稠合的七元内酰胺的环保，经济和有效的方法。
• SHINDE, B. R.;SHENOY, S. J.;PAI, N. R., INDIAN J. CHEM. B, 29,(1990) N, C. 711-720
  作者：SHINDE, B. R.、SHENOY, S. J.、PAI, N. R.

  DOI：——

  日期：——
• Hazard identification and risk assessment procedure for genetically modified plants in the field—GMHAZID
  作者：Raija A. Koivisto、Kirsi M. Törmäkangas、Veli S. Kauppinen

  DOI：10.1007/bf02987457

  日期：2002.3

  The safe application of genetically modified organisms (GMOs) requires a risk assessment prior to their proposed use. Based on methods from the chemical industry, we developed a hazard identification procedure for the risk assessment of field tests with genetically modified plants. This risk assessment method, GMHAZID, is carried out in the form of guided brainstorm sessions. GMHAZID was tested with a case study for which a risk assessment had previously been made, and the results of the assessments were compared. The results showed that some new hazards potentially leading to uncontrolled spreading, in addition to those from the previous assessment, were identified using GMHAZID. GMHAZID also recognised some hazards leading to failures in the field experiments. We suggest that GMHAZID provides systematics, reliability, and transparency to the risk assessment procedure.
• Shinde; Shenoy; Pai, Indian Journal of Chemistry - Section B Organic and Medicinal Chemistry, 1990, vol. 29, # 8, p. 711 - 720
  作者：Shinde、Shenoy、Pai

  DOI：——

  日期：——