N-benzyl-N-hydroxy-formamide | 31335-70-3

• 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: N-benzyl-N-hydroxy-formamide
• 英文别名: N-Benzyl-N-hydroxy-formamid；N-Formyl-N-benzyl-hydroxylamin；N-Benzyl-formhydroxamsaeure；benzyl-(N-hydroxy)formamide；N-benzyl-N-hydroxyformamide
• CAS: 31335-70-3
• 化学式: C₈H₉NO₂
• 分子量: 151.165
• InChiKey: DTDVWUSGUXOBQB-UHFFFAOYSA-N

物化性质

• 熔点：
  49-50 °C
• 沸点：
  299.8±33.0 °C(Predicted)
• 密度：
  1?+-.0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  0.7
• 重原子数：
  11
• 可旋转键数：
  2
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.12
• 拓扑面积：
  40.5
• 氢给体数：
  1
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  N-benzyl-N-hydroxy-formamide 、 alkaline earth salt of/the/ methylsulfuric acid 生成 异氰酸苄酯
  参考文献：
  名称：

  Jones; Sneed, Journal of the American Chemical Society, 1917, vol. 39, p. 673

  摘要：

  DOI：
• 作为产物：
  描述：

  N-benzyl-O-benzoylhydroxylamine hydrochloride 在 sodium hydroxide 、 sodium acetate 作用下， 以 甲醇 为溶剂， 反应 0.25h， 生成 N-benzyl-N-hydroxy-formamide
  参考文献：
  名称：

  异羟肟酸的构象行为

  摘要：

  N-甲酰基-N-烷基羟胺，N-甲酰基-α-N-羟基氨基酸酸酯和一些N-乙酰基类似物以Z / E平衡混合物形式存在，如H-NMR和IR所示。研究了Z / E比对N-取代基，酰基和溶剂性质的依赖性。对于大体积的N-取代基和非极性溶剂以及O-质子化形式，Z-异构体是优选的。在一系列甲酰基异羟肟酸中计算了围绕羰基-氮键旋转的活化自由能。

  DOI：

  10.1016/s0040-4020(01)88683-x

文献信息

• 1,3-Dihydro-2H-Indole-2-One Compound and Pyrrolidine-2-One Compound Fused With Aromatic Heterocycle
  申请人：Sekiguchi Yoshinori

  公开号：US20080318923A1

  公开（公告）日：2008-12-25

  It is intended to provide a drug which is efficacious against pathological conditions relating to arginine-vasopressin V1b receptor. More particularly speaking, it is intended to provide a drug which has a therapeutic or preventive effect on depression, anxiety, Alzheimer's disease, Parkinson's disease, Huntington's chorea, eating disorders, hypertension, digestive diseases, drug addiction, epilepsy, brain infarction, brain ischemia, brain edema, head injury, inflammation, immune diseases, alopecia and so on. As the results of intensive studies, a novel 1,3-dihydro-2H-indol-2-one compound and a pyrrolidin-2-one compound fused with a heteroaromatic ring, which are highly selective antagonists of arginine-vasopressin V1b receptor, have high metabolic stabilities and show favorable brain penetration and high plasma concentrations, are found, thereby achieving the above objective.

  旨在提供一种对与精氨酸加压素V1b受体相关的病理状况具有疗效的药物。更具体地说，旨在提供一种对抑郁症、焦虑症、阿尔茨海默病、帕金森病、亨廷顿舞蹈症、进食障碍、高血压、消化系统疾病、药物成瘾、癫痫、脑梗死、脑缺血、脑水肿、头部损伤、炎症、免疫疾病、脱发等具有治疗或预防作用的药物。经过深入研究，发现了一种新颖的1,3-二氢-2H-吲哚-2-酮化合物和与杂芳环融合的吡咯烷-2-酮化合物，它们是高度选择性的精氨酸加压素V1b受体拮抗剂，具有高代谢稳定性，表现出有利的血脑屏障穿透和高血浆浓度，从而实现了上述目标。
• Process for the selective N-formylation of N-hydroxylamines
  申请人：——

  公开号：US20010031896A1

  公开（公告）日：2001-10-18

  The instant invention provides a process for the selective N-formylation of N-hydroxylamines.

  这项瞬时发明提供了一种选择性N-甲酰化N-羟胺的过程。
• Amine derivative compounds
  申请人：SANKYO COMPANY, LIMITED

  公开号：US20030078426A1

  公开（公告）日：2003-04-24

  An amine compound of the formula (I): 1 wherein R 1 represents an optionally substituted carbamoyl group, etc., R 2 represents a hydrogen atom, etc., R 3 represents a C 1 -C 10 alkyl group etc., W 1 , W 2 and W 3 are the same or different and each represent a single bond or a C 1 -C 8 alkylene group, X, Y and Q represent a sulfur atom, etc., Z represents a ═CH— group, etc., Ar represents a benzene ring, etc. and L represents a hydrogen atom, etc., or a pharmacologically acceptable salt thereof. These compounds are useful in the treatment and/or prophylaxis of diseases such as diabetes, hyperlipemia, arteriosclerosis, cancer, etc.

  化合物的结构式（I）如下：其中R1代表可选择取代的氨基甲酰基团，R2代表氢原子等，R3代表C1-C10烷基等，W1、W2和W3相同或不同，每个代表单键或C1-C8烷基链，X、Y和Q代表硫原子等，Z代表═CH—基团等，Ar代表苯环等，L代表氢原子等，或其药理学上可接受的盐。这些化合物在治疗和/或预防糖尿病、高脂血症、动脉硬化、癌症等疾病方面具有用处。
• Vanilloid Fatty Hydroxamates as Therapeutic Anti-inflammatory Pharmaceuticals
  申请人：Laskin Jeffrey D.

  公开号：US20120252891A1

  公开（公告）日：2012-10-04

  Three unique subtypes of N-hydroxyamides and N-hydroxycarbamates containing both the vanilloid moiety (4-hydroxy-3-methoxybenzyl) and a lipophilic aliphatic moiety. Also disclosed are direct syntheses of these vanilloid fatty hydroxamates. The compounds possess inhibitory activity against the enzymes fatty acid amide hydrolase (FAAH) and matrix metallo-proteinase 9 (MMP-9). In addition, these substances bind to the calcium channel protein TRPV1 and inhibit vesicant-induced inflammation in skin and cornea. The compounds have utility in treating topical or systemic inflammatory processes in the skin and/or eye.

  含有香草酰基（4-羟基-3-甲氧基苯甲基）和疏水脂肪族基的三种独特的N-羟基酰胺和N-羟基氨基甲酸酯亚型。还披露了这些香草脂肪羟胺的直接合成。这些化合物具有抑制酶脂肪酸酰胺水解酶（FAAH）和基质金属蛋白酶9（MMP-9）的活性。此外，这些物质结合到钙通道蛋白TRPV1并抑制引起皮肤和角膜炎症的溃疡剂。这些化合物在治疗皮肤和/或眼部的局部或全身炎症过程中具有用途。
• 2,2,2-Trifluoroethyl Formate:  A Versatile and Selective Reagent for the Formylation of Alcohols, Amines, and <i>N</i>-Hydroxylamines
  作者：David R. Hill、Chi-Nung Hsiao、Ravi Kurukulasuriya、Steven J. Wittenberger

  DOI：10.1021/ol016976d

  日期：2002.1.1

  [reaction: see text] Treatment of a variety of alcohols, amines, and N-hydroxylamines with 2,2,2-trifluoroethyl formate gave the corresponding formylated adducts in high yields.

  [反应：见正文]用2,2,2-三氟乙基甲酸酯处理各种醇，胺和N-羟胺，可以高收率得到相应的甲酰化加合物。