δ-benzoylvaleric acid chloride | 56721-39-2

• 分子结构分类: 有机化合物 - 有机氧化合物
• 英文名称: δ-benzoylvaleric acid chloride
• 英文别名: 6-oxo-6-phenylhexanoyl chloride；5-benzoylpentanoyl chloride；δ-Benzoyl-valeriansaeure-chlorid
• CAS: 56721-39-2
• 化学式: C₁₂H₁₃ClO₂
• 分子量: 224.687
• InChiKey: PKUNCVJBJZMYLD-UHFFFAOYSA-N

物化性质

• 沸点：
  338.9±25.0 °C(Predicted)
• 密度：
  1.149±0.06 g/cm3(Predicted)

计算性质

• 辛醇/水分配系数(LogP)：
  2.7
• 重原子数：
  15
• 可旋转键数：
  6
• 环数：
  1.0
• sp3杂化的碳原子比例：
  0.33
• 拓扑面积：
  34.1
• 氢给体数：
  0
• 氢受体数：
  2

安全信息

• 海关编码：
  2918300090

反应信息

• 作为反应物：
  描述：

  δ-benzoylvaleric acid chloride 在 氨 作用下， 以 苯 为溶剂， 生成 6-oxo-6-phenylhexanamide
  参考文献：
  名称：

  Eistert,B., Justus Liebigs Annalen der Chemie, 1961, vol. 650, p. 133 - 156

  摘要：

  DOI：
• 作为产物：
  描述：

  2-benzoylcyclopentanone 在 氢氧化钾 、 氯化亚砜 作用下， 生成 δ-benzoylvaleric acid chloride
  参考文献：
  名称：

  Eistert,B., Justus Liebigs Annalen der Chemie, 1961, vol. 650, p. 133 - 156

  摘要：

  DOI：

文献信息

• Palladium-Catalyzed Reduction of Acid Chlorides to Aldehydes with Hydrosilanes
  作者：Yasushi Tsuji、Tetsuaki Fujihara、Cong Cong、Tomohiro Iwai、Jun Terao

  DOI：10.1055/s-0032-1317155

  日期：——

  efficient synthesis of aldehydes from acid chlorides with hydrosilanes as a reducing agent in the presence of a palladium catalyst has been achieved. A simple mixture of commercially available Pd(dba)2 and Mes3P as a catalyst realized the reduction of various acid chlorides including aliphatic acid chlorides and α,β-­unsaturated acid chlorides to the corresponding aldehydes in good to high yields under

  在钯催化剂的存在下，用氢硅烷作为还原剂从酰氯有效合成醛。市售的 Pd(dba)2 和 Mes3P 的简单混合物作为催化剂，在温和的反应条件下实现了将包括脂肪族酰氯和 α,β-不饱和酰氯在内的各种酰氯还原为相应的醛类。
• Nonacarbonyldiiron-, Pentacarbonyliron-, or Hexacarbonylmolybdenum-induced Reactions of 4,5-Polymethylene-substituted 2-Isoxazolines
  作者：Makoto Nitta、Akihiro Yi、Tomoshige Kobayashi

  DOI：10.1246/bcsj.58.991

  日期：1985.3

  4-hydroxy-1-phenyl-1-butanone, via the N–O and C–C bond cleavage of the 2-isoxazoline ring and the subsequent hydrolysis. The similar reaction of 7a-morpholino- and 7a-(1-pyrrolidinyl)-3-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzoisoxazoles undergoes the N–O bond cleavage and, the subsequent elimination of the amino group or the C-3a–C-7a bond fission. Although the reaction of 6a-morpholino- and 6a-(1

  4,5-聚亚甲基取代的2-异恶唑啉、3-苯基-3a,5,6,7a-四氢-4H-吡喃并[3,2-d]异恶唑或3-苯基-3a,4,5的反应， 6a-四氢呋喃[3,2-d]异恶唑与[Fe2(CO)9]、[Fe(CO)5]或[Mo(CO)6]形成5-羟基-1-苯基- 1-戊酮或 4-羟基-1-苯基-1-丁酮，通过 2-异恶唑啉环的 N-O 和 C-C 键断裂和随后的水解。7a-morpholino-和 7a-(1-pyrrolidinyl)-3-phenyl-3a,4,5,6,7,7a-hexahydro-1,2-benzoisoxazoles 的类似反应发生 N-O 键断裂，随后消除氨基或 C-3a-C-7a 键裂变。尽管 6a-morpholino- 和 6a-(1-pyrrolidinyl)-3-phenyl-3a,4,5,6a-tetrahydro-4H-cyclopent[d]isoxazoles
• Ferrocene compounds and preparation
  申请人：Frisons Limited

  公开号：US03960911A1

  公开（公告）日：1976-06-01

  There are described compounds of formula I, ##SPC1## in which R is alkyl, chlorine, bromine, phenyl, or phenyl substituted by one or more halogen or alkyl groups, One of X and Y is group --CO--, --CHOH-- or --CH.sub.2 -- and the other is an exocyclic carbon-carbon bond linking the ferrocenyl or the R group respectively to the -A- group, A contains 5, 6 or 7 carbon atoms and is an ethylenically unsaturated (the double bond being connected to the carbon atom which is connected to X), unsubstituted (except by X and Y) cyclic hydrocarbon group; or is a saturated cyclic hydrocarbon group substituted by X and Y and, when X is a group --CO-, optionally substituted on the carbon atom to which Y is attached by an -OH group, and X and Y are attached to adjacent carbon atoms on the A group. There are also described processes for the production of compounds of formula I and haematinic compositions containing them.

  描述了一种符号I的化合物，##SPC1##其中R是烷基、氯、溴、苯基或苯基，或者苯基上有一个或多个卤素或烷基基团，X和Y中的一个是羰基--CO--、羟甲基--CHOH--或亚甲基--CH.sub.2--，另一个是将二茂铁基团或R基与-A-基团分别连接的外环碳-碳键，A包含5、6或7个碳原子，是一个乙烯基不饱和（双键连接到与X相连的碳原子）的环烃基团，未经取代（除了X和Y）；或者是由X和Y取代的饱和环烃基团，并且当X是羰基--CO-时，可以选择性地在Y连接的碳原子上用-OH基团取代，X和Y连接到A基团上相邻的碳原子。还描述了制备符号I化合物和含有它们的补血剂组合物的方法。
• Compounds
  申请人：Fisons Limited

  公开号：US03966783A1

  公开（公告）日：1976-06-29

  There are described compounds of formula I, ##SPC1## in which X is a saturated hydrocarbon group containing from 2 to 10 carbon atoms inclusive, and R is alkyl, phenyl, or phenyl substituted by one or more halogen or alkyl groups. There are also described processes for making the compounds and haematinic compositions containing them.

  本文描述了公式I的化合物，其中X是一个饱和的碳氢基团，含有2到10个碳原子，R是烷基，苯基或苯基取代物，其中取代基可以是一个或多个卤素或烷基基团。还描述了制备这些化合物的过程以及含有它们的补血剂组合物。
• Treating iron deficiency anaemia
  申请人：Fisons Limited

  公开号：US04038413A1

  公开（公告）日：1977-07-26

  There are described compounds of formula I, ##STR1## IN WHICH R is allyl, chlorine, bromine, phenyl, or phenyl substituted by one or more halogen or alkyl groups, One of X and Y is a group --CO--, --CHOH-- or --CH.sub.2 -- and the other is an exocyclic carbon-carbon bond linking the ferrocenyl or the R group respectively to the --A-- group, A contains 5, 6 or 7 carbon atoms and is an ethylenically unsaturated (the double bond being connected to the carbon atom which is connected to X), unsubstituted (except by X and Y) cyclic hydrocarbon group; or is a saturated cyclic hydrocarbon group substituted by X and Y and, when X is a group --CO--, optionally substituted on the carbon atom to which Y is attached by an --OH group, and X and Y are attached to adjacent carbon atoms on the A group. There are also described processes for the production of compounds of formula I and haematinic compositions containing them.

  描述了公式I的化合物，其中R是烯丙基，氯，溴，苯基或被一种或多种卤素或烷基取代的苯基。X和Y中的一个是羰基，CHOH或CH2，另一个是外环碳-碳键，将二茂铁基或R基分别连接到A基，A含有5、6或7个碳原子，并且是一个具有乙烯基不饱和性（双键连接到与X连接的碳原子）的未取代（除X和Y外）的环烃基；或是由X和Y取代的饱和环烃基，并且当X是羰基时，可以在Y连接的碳原子上被一个-OH基团取代，且X和Y连接到A基上相邻的碳原子上。还描述了制备公式I化合物的过程和含有它们的补血剂组合物。