9-(isocyanatomethyl)anthracene | 97761-46-1

• 分子结构分类: 有机化合物 - 苯类化合物 - 蒽
• 英文名称: 9-(isocyanatomethyl)anthracene
• 英文别名: 9-anthrylmethyl isocyanate；9-Anthrylmethyl isocyanate
• CAS: 97761-46-1
• 化学式: C₁₆H₁₁NO
• 分子量: 233.269
• InChiKey: RYXBPWCRFIEWCV-UHFFFAOYSA-N

物化性质

• 沸点：
  417.8±24.0 °C(Predicted)
• 密度：
  1.12±0.1 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  5.4
• 重原子数：
  18
• 可旋转键数：
  2
• 环数：
  3.0
• sp3杂化的碳原子比例：
  0.06
• 拓扑面积：
  29.4
• 氢给体数：
  0
• 氢受体数：
  2

反应信息

• 作为反应物：
  描述：

  9-(isocyanatomethyl)anthracene 在 氨 作用下， 以 四氢呋喃 为溶剂， 反应 24.0h， 以93%的产率得到1-(anthracen-9-ylmethyl)urea
  参考文献：
  名称：

  Anthracene-Fe3+ ensemble based turn-on fluorescent probes for selective detection of fluoride

  摘要：

  Two new and simple chemosensors, 1-(anthracen-9-ylmethyl)urea (3a) and 1-(anthracen-9-ylmethyl)thiourea (3b) bearing anthracene moiety, were synthesized from anthracen-9-ylmethanamine. Their UV-Vis absorption, fluorescence emission and potential application for the detection of ions were investigated. Of note is that their fluorescence emission excited with 370 nm could be quenched upon addition of Fe3+, whereby the highly selective recognition for Fe3+ was noticed. Furthermore, ensembles based on 3a-Fe3+ and 3b-Fe3+ complexes having the specific binding affinity for F- show rapid and selective detection of F- over other anions with a fluorescence turn-on mode. (C) 2015 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2015.06.025
• 作为产物：
  描述：

  三光气 、 1-(9-蒽基)甲胺 在 三乙胺 作用下， 以 二氯甲烷 为溶剂， 反应 25.0h， 以85%的产率得到9-(isocyanatomethyl)anthracene
  参考文献：
  名称：

  Anthracene-Fe3+ ensemble based turn-on fluorescent probes for selective detection of fluoride

  摘要：

  Two new and simple chemosensors, 1-(anthracen-9-ylmethyl)urea (3a) and 1-(anthracen-9-ylmethyl)thiourea (3b) bearing anthracene moiety, were synthesized from anthracen-9-ylmethanamine. Their UV-Vis absorption, fluorescence emission and potential application for the detection of ions were investigated. Of note is that their fluorescence emission excited with 370 nm could be quenched upon addition of Fe3+, whereby the highly selective recognition for Fe3+ was noticed. Furthermore, ensembles based on 3a-Fe3+ and 3b-Fe3+ complexes having the specific binding affinity for F- show rapid and selective detection of F- over other anions with a fluorescence turn-on mode. (C) 2015 Elsevier B.V. All rights reserved.

  DOI：

  10.1016/j.jfluchem.2015.06.025

文献信息

• [EN] ADAMANTANE BISUREA DERIVATIVES, METHOD OF PREPARATION AND APPLICATION IN ANION SENSING<br/>[FR] DÉRIVÉS D'ADAMANTANE-BISURÉE, PROCÉDÉ DE PRÉPARATION ET APPLICATION À LA DÉTECTION D'ANIONS
  申请人：RUDJER BOSKOVIC INST

  公开号：WO2010112946A1

  公开（公告）日：2010-10-07

  The invention relates to adamantane bisurea derivatives and their use. Adamantane bisurea derivatives are obtained by reaction of adamantane diamine with appropriate isocyanate, or by in situ preparation of adamantane isocyanate from adamantane diacid and subsequent reaction with the appropriate amine. Adamantane bisureas bind the following anions: F-, Cl-, Br-, acetate, HSO4- NO3-, and H2PO4-, and particularly F- and H2PO4-. The presence of anions can be detected by UV -vis or fluorescence spectroscopy. Formula (I).
• Anthracene-Fe3+ ensemble based turn-on fluorescent probes for selective detection of fluoride
  作者：Xiaoliang Dong、Yuhan Zhou、Yuming Song、Jingping Qu

  DOI：10.1016/j.jfluchem.2015.06.025

  日期：2015.10

  Two new and simple chemosensors, 1-(anthracen-9-ylmethyl)urea (3a) and 1-(anthracen-9-ylmethyl)thiourea (3b) bearing anthracene moiety, were synthesized from anthracen-9-ylmethanamine. Their UV-Vis absorption, fluorescence emission and potential application for the detection of ions were investigated. Of note is that their fluorescence emission excited with 370 nm could be quenched upon addition of Fe3+, whereby the highly selective recognition for Fe3+ was noticed. Furthermore, ensembles based on 3a-Fe3+ and 3b-Fe3+ complexes having the specific binding affinity for F- show rapid and selective detection of F- over other anions with a fluorescence turn-on mode. (C) 2015 Elsevier B.V. All rights reserved.