邻氨基苯甲酸异戊酯 | 28457-05-8

• 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: 邻氨基苯甲酸异戊酯
• 英文名称: 3-methylbutyl anthranilate
• 英文别名: anthranilic acid isopentyl ester；2-Amino-benzoesaeure-isoamylester；Anthranilsaeure-isopentylester；Anthranilsaeure-isoamylester；3-Methylbutyl 2-aminobenzoate
• CAS: 28457-05-8
• 化学式: C₁₂H₁₇NO₂
• 分子量: 207.272
• InChiKey: YXMRIWCMMGEYBH-UHFFFAOYSA-N

物化性质

• 沸点：
  306.8±15.0 °C(Predicted)
• 密度：
  1.057±0.06 g/cm3(Predicted)
• LogP：
  4.061 (est)
• 保留指数：
  1664.9;1656

计算性质

• 辛醇/水分配系数(LogP)：
  3.9
• 重原子数：
  15
• 可旋转键数：
  5
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.42
• 拓扑面积：
  52.3
• 氢给体数：
  1
• 氢受体数：
  3

安全信息

• 海关编码：
  2922439000

反应信息

• 作为反应物：
  描述：

  苯甲酰乙酸乙酯 、 邻氨基苯甲酸异戊酯 以40%的产率得到
  参考文献：
  名称：

  TYURINA L. N.; DOLBIN V. N.; MOSKALENKO Z. I.; LAPSHIN G. N., SB. NAUCH. TR. BCEC. N.-I. I PROEKT. IN-T XIM.-FOTOGR. PROM-STI, 1975, VY+

  摘要：

  DOI：
• 作为产物：
  描述：

  2-nitro-benzoic acid isopentyl ester 以98%的产率得到
  参考文献：
  名称：

  TYURINA L. N.; DOLBIN V. N.; MOSKALENKO Z. I.; LAPSHIN G. N., SB. NAUCH. TR. BCEC. N.-I. I PROEKT. IN-T XIM.-FOTOGR. PROM-STI, 1975, VY+

  摘要：

  DOI：

文献信息

• Structure-activity relationships of fungicidal N-benzoylanthranilic esters.
  作者：Osamu KIRINO、Shigeo YAMAMOTO、Toshiro KATO

  DOI：10.1271/bbb1961.44.2149

  日期：——

  The antifungal activity of 37 N-(methoxy-substituted benzoyl)anthranilic esters was tested on the powdery mildew of barley caused by Erysiphe graminis by the pot test. Among the methyl N-(methoxy-substituted benzoyl)anthranilates tested, 3, 4-dimethoxybenzoyl derivative exhibited the highest activity. The variation in fungicidal activity of N-(3, 4-dimethoxy-benzoyl)anthranilic esters was shown to be related with variation in hydrophobicity and the electronic property of the alcohol moiety of the ester. The branching at the α-position of the alcohol moiety of the ester was detrimental to the activity.

  37种N-(甲氧基取代的苯甲酰)蒽醌酯的抗真菌活性通过盆栽试验在由小麦白粉病（Erysiphe graminis）引起的大麦粉状霉菌上进行了测试。在测试的甲基N-(甲氧基取代的苯甲酰)蒽醌酯中，3,4-二甲氧基苯甲酰衍生物表现出最高的活性。N-(3,4-二甲氧基苯甲酰)蒽醌酯的杀真菌活性的变化被证明与酯的醇基的疏水性和电子性质的变化相关。醇基在α位的支链对活性是有害的。
• Plasticized thermoset resin, and associated cured resin, method of curing, and article comprising cured resin
  申请人：The University of Massachusetts

  公开号：US10913844B2

  公开（公告）日：2021-02-09

  A curable composition includes a hydrogen-bonded prepolymer, a plasticizer, and, optionally, a crosslinking agent. The plasticizer includes a reactive plasticizer having structure (I), (II), or (III), wherein X is —OR1, —N(R1)2, —R4—OR1, or —R4—N(R1)2, wherein R1 is independently at each occurrence hydrogen or C1-6 alkyl, and R4 is C1-12 alkylene; y is zero or 1; z is zero or 1; R2 is C1-12 alkyl; and R3 is C1-12 alkyl when z is 1, or R3 is C1-12 alkyl or H when z is zero.

  一种可固化组合物包括氢键预聚物、增塑剂和可选的交联剂。增塑剂包括具有结构(I)、(II)或(III)的反应性增塑剂，其中 X 为-OR1、-N(R1)2、-R4-OR1 或-R4-N(R1)2，其中 R1 在每次出现时独立地为氢或 C1-6 烷基，R4 为 C1-12 亚烷基；y 为零或 1；z 为零或 1；R2 为 C1-12 烷基；当 z 为 1 时，R3 为 C1-12 烷基，或当 z 为零时，R3 为 C1-12 烷基或 H。
• Synthesis, antimicrobial evaluation, ot-QSAR and mt-QSAR studies of 2-amino benzoic acid derivatives
  作者：Kuldeep Mahiwal、Pradeep Kumar、Balasubramanian Narasimhan

  DOI：10.1007/s00044-010-9537-5

  日期：2012.3

  A series of 2-amino benzoic acid derivatives (1-28) were synthesized and evaluated for their in vitro antimicrobial activity against the panel of Gram positive, Gram negative bacterial and fungal strains. The results of antimicrobial studies indicated that, in general, the synthesized compounds were found to be bacteriostatic and fungistatic in action. QSAR studies performed by the development of one target and multi target models indicated that multi-target model was effective in describing the antimicrobial activity as well demonstrated the effect of structural parameters viz. LUMO, (3)chi(v) and W on antimicrobial activity of 2-amino benzoic acid derivatives.
• Bredt; Hof, Chemische Berichte, 1900, vol. 33, p. 29
  作者：Bredt、Hof

  DOI：——

  日期：——
• PLASTICIZED THERMOSET RESIN, AND ASSOCIATED CURED RESIN, METHOD OF CURING, AND ARTICLE COMPRISING CURED RESIN
  申请人：The University of Massachusetts

  公开号：EP3481899A1

  公开（公告）日：2019-05-15