3,4-二甲氧基硝基苯甲酸甲酯 | 71750-43-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 苯和取代衍生物
• 中文名称: 3,4-二甲氧基硝基苯甲酸甲酯
• 中文别名: 甲基3,4-二甲氧基硝基苯酸酯
• 英文名称: 3,4-dimethoxy-2-nitro-benzoic acid methyl ester
• 英文别名: 3,4-Dimethoxy-2-nitro-benzoesaeure-methylester；2-Nitro-veratrumsaeure-methylester；Methyl 3,4-dimethoxy-2-nitrobenzoate
• CAS: 71750-43-1
• 化学式: C₁₀H₁₁NO₆
• 分子量: 241.2
• InChiKey: ZGIUTJWCSIHWGS-UHFFFAOYSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  1.5
• 重原子数：
  17
• 可旋转键数：
  4
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.3
• 拓扑面积：
  90.6
• 氢给体数：
  0
• 氢受体数：
  6

反应信息

• 作为反应物：
  描述：

  3,4-二甲氧基硝基苯甲酸甲酯 生成 3,4-二甲氧基-2-硝基苯甲酸
  参考文献：
  名称：

  A new exhalite type—siderite-sericite chert formed in fault-controlled lacustrine basin

  摘要：

  On the basis of geological, fabric, lithographical and mineralogical study, a new exhalite type, called 'siderite-sericite chert' according to its mineral assemblage, was reported for the first time. It was formed in a fault-controlled lacustrine basin and closely associated with sulfide ore characteristic of complex metal assemblage of Sn-Ag-Cu-Pb-Zn. Its geological setting, mineral assemblage, as well as associated ores are quite unique, and therefore worthy of detailed research. In the Dajing deposit, Linxi County, Inner Mongolia, it is this very exhalite that is regarded as a kind of acidic subvolcanic dike till now, and because of this, a genetic model of hydrothermal epigenetic filling by subvolcanic fluid prevails over the Dajing deposit. It is demonstrated again that any geochemical study might be senseless without support of detailed geological and lithographical investigations. This is of particular importance at the present time when one is readily confused by various modern techniques.

  DOI：

  10.1007/bf02906864
• 作为产物：
  描述：

  4-羟基-3-甲氧基-2-硝基苯甲醛 在 盐酸 、 氢氧化钾 、 potassium permanganate 作用下， 生成 3,4-二甲氧基硝基苯甲酸甲酯
  参考文献：
  名称：

  Pschorr; Sumuleanu, Chemische Berichte, 1899, vol. 32, p. 3407

  摘要：

  DOI：

文献信息

• Endothelin receptor antagonists: synthesis and structure–activity relationships of substituted benzothiazine-1,1-dioxides
  作者：K.A. Berryman、J.J. Edmunds、A.M. Bunker、S. Haleen、J. Bryant、K.M. Welch、A.M. Doherty

  DOI：10.1016/s0968-0896(98)00080-7

  日期：1998.9

  The development of benzothiazine-1,1-dioxide derivatives as a new structural class of potent endothelin receptor antagonists is described. Structure-activity relationships (SAR) revealed that PD164800 (1) is a potent antagonist of the ETA receptor subtype. (C) 1998 Elsevier Science Ltd. All rights reserved.
• Klemenc, Monatshefte fur Chemie, 1914, vol. 35, p. 95
  作者：Klemenc

  DOI：——

  日期：——
• TOMITA; KUGO, Pharmaceutical bulletin, 1954, vol. 2, # 2, p. 115 - 118
  作者：TOMITA、KUGO

  DOI：——

  日期：——
• Ohta; Mori, 1955, # 5, p. 336
  作者：Ohta、Mori

  DOI：——

  日期：——
• Pschorr; Sumuleanu, Chemische Berichte, 1899, vol. 32, p. 3407
  作者：Pschorr、Sumuleanu

  DOI：——

  日期：——