6-hydroxybenzopyrene | 33953-73-0

• 分子结构分类: 有机化合物 - 苯类化合物 - 芘
• 英文名称: 6-hydroxybenzopyrene
• 英文别名: benzopyren-6-ol；6-hydroxy-benzo[a]pyrene；benzo[def]chrysen-6-ol；6-Hydroxy-benzo[def]chrysen；6-Hydroxy-benzo[a]pyren；Benzo[a]pyrenol-(6)；6-Hydroxybenzo[a]pyrene；benzo[b]pyren-6-ol
• CAS: 33953-73-0
• 化学式: C₂₀H₁₂O
• 分子量: 268.315
• InChiKey: MGTMTTGZMPDIQS-UHFFFAOYSA-N

物化性质

• 熔点：
  208°C
• 沸点：
  371.47°C (rough estimate)
• 密度：
  1.0921 (rough estimate)

计算性质

• 辛醇/水分配系数(LogP)：
  5.9
• 重原子数：
  21
• 可旋转键数：
  0
• 环数：
  5.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  20.2
• 氢给体数：
  1
• 氢受体数：
  1

安全信息

• 海关编码：
  2906299090

SDS

制备方法与用途

类别：有毒物品

可燃性危险特性：

• 可燃；燃烧时会产生刺激性烟雾

储运特性：

• 通风、低温、干燥

灭火剂：

• 干粉、泡沫、沙土、二氧化碳、雾状水

反应信息

• 作为反应物：
  描述：

  6-hydroxybenzopyrene 在 亚硝酸正戊酯 、 硫酸 、 溶剂黄146 作用下， 生成 苯并[b]芘-1,6-二酮
  参考文献：
  名称：

  A Striking, Multifaceted, Decalithium Aggregate with Carbanion, Organoamide, and Alkoxide Functionalities

  摘要：

  The three most important "superbase" anionic building blocks are contained in the striking decalithium aggregate in the structure of which a single lithium atom is surrounded solely by an amide, an alkoxide, and a carbanion.

  DOI：

  10.1002/1521-3773(20010601)40:11<2108::aid-anie2108>3.0.co;2-c
• 作为产物：
  描述：

  6-氟苯并(a)芘 以 硫酸 为溶剂， 反应 10.0h， 生成 6-hydroxybenzopyrene
  参考文献：
  名称：

  EPR and ENDOR studies of 6-substituted benzo[a]pyrene cation radicals

  摘要：

  DOI：

  10.1021/ja00262a012

文献信息

• An estrogen binding proteinaceous substance, its possible role in estrogen action, and potential use.
  申请人：Rao, Ramanath B.

  公开号：EP0939084A1

  公开（公告）日：1999-09-01

  The invention relates to an estrogen binding proteinaceous substance. The substance is different from the classical cytosol or nuclear ER (type I and II) in a number of characteristics. The novel estrogen binding substances according to the invention will be collectively referred to as estrogen binding protein (EBP). The invention provides a murine estrogen binding proteinaceous substance or a mammalian equivalent thereof, the murine substance comprising a subunit having a molecular weight of about 61-67 kD as analyzed by SDS-PAGE. In its active form this proteinaceous substance usually appears as a heterodimer, whereby one subunit of the murine substance is the 61-67 kD proteinaceous substance and the other subunit is a 17-22kD proteinaceous substance, whereby the resulting heterodimer has a molecular weight of about 81-84 kD as measured by gel electrophoresis. The genes encoding EBP and antibodies directed against EBP are also part of the invention.

  本发明涉及一种雌激素结合蛋白物质。这种物质与经典的细胞质或细胞核 ER（I 型和 II 型）有许多不同之处。根据本发明的新型雌激素结合物质统称为雌激素结合蛋白（EBP）。 本发明提供了一种鼠类雌激素结合蛋白物质或其哺乳动物等效物，鼠类物质包括一个亚基，经 SDS-PAGE 分析，其分子量约为 61-67 kD。 在其活性形式中，这种蛋白物质通常表现为异源二聚体，其中鼠类物质的一个亚基是 61-67 kD 的蛋白物质，另一个亚基是 17-22 kD 的蛋白物质，由此产生的异源二聚体经凝胶电泳测定的分子量约为 81-84 kD。 编码 EBP 的基因和针对 EBP 的抗体也是本发明的一部分。
• Photochemical Generation of Nitric Oxide from 6-Nitrobenzo[<i>a</i>]pyrene
  作者：Kiyoshi Fukuhara、Masaaki Kurihara、Naoki Miyata

  DOI：10.1021/ja0109038

  日期：2001.9.1

  Photolabile 6-nitrobenzo[a]pyrene (6-nitroBaP) released nitric oxide (NO) under visible-light irradiation. The generation of NO and the concomitant formation of the 6-oxyBaP radical were confirmed by ESR. BaP quinones were also detected as further oxidized products of the 6-oxyBaP radical. No such photodegradation was observed with other nitrated BaPs, such as 1-nitroBaP and 3-nitroBaP. DNA-strand breakage, caused by photoexcited 6-nitroBaP, was closely related to its NO-releasing activity. MO calculations of nitrated BaP suggest that the perpendicular conformation of the nitro substituent to the aromatic ring is important for the release of NO with light. These findings may be useful for the development of a new type of NO donor.
• Weeratunga, Gamini; Austrup, Mona; Rodrigo, Russell, Journal of the Chemical Society. Perkin transactions I, 1988, p. 3169 - 3174
  作者：Weeratunga, Gamini、Austrup, Mona、Rodrigo, Russell

  DOI：——

  日期：——
• 509. The action of benzoyl peroxide on polycyclic aromatic hydrocarbons
  作者：Ivan M. Roitt、William A. Waters

  DOI：10.1039/jr9520002695

  日期：——
• GIBSON T. L.; SMITH L. L., J. ORG. CHEM., 1979, 44, NO 11, 1842-1846
  作者：GIBSON T. L.、 SMITH L. L.

  DOI：——

  日期：——