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trans-1-(4-acetylphenyl)-3-(dimethylamino)propenone | 825633-03-2

中文名称
——
中文别名
——
英文名称
trans-1-(4-acetylphenyl)-3-(dimethylamino)propenone
英文别名
1-(4-acetylphenyl)-3-dimethylaminopropenone;(E)-1-(4-acetylphenyl)-3-(dimethylamino)prop-2-en-1-one
trans-1-(4-acetylphenyl)-3-(dimethylamino)propenone化学式
CAS
825633-03-2
化学式
C13H15NO2
mdl
——
分子量
217.268
InChiKey
CZJBANWWHTZACU-CMDGGOBGSA-N
BEILSTEIN
——
EINECS
——
  • 物化性质
  • 计算性质
  • ADMET
  • 安全信息
  • SDS
  • 制备方法与用途
  • 上下游信息
  • 反应信息
  • 文献信息
  • 表征谱图
  • 同类化合物
  • 相关功能分类
  • 相关结构分类

计算性质

  • 辛醇/水分配系数(LogP):
    1.7
  • 重原子数:
    16
  • 可旋转键数:
    4
  • 环数:
    1.0
  • sp3杂化的碳原子比例:
    0.23
  • 拓扑面积:
    37.4
  • 氢给体数:
    0
  • 氢受体数:
    3

SDS

SDS:5ea3227ed44ff26bb381d5554ade1746
查看

上下游信息

  • 上游原料
    中文名称 英文名称 CAS号 化学式 分子量
  • 下游产品
    中文名称 英文名称 CAS号 化学式 分子量

反应信息

  • 作为反应物:
    描述:
    trans-1-(4-acetylphenyl)-3-(dimethylamino)propenone乙酸铵 作用下, 以 溶剂黄146 为溶剂, 反应 1.0h, 以82%的产率得到2-(4-acetylphenyl)-5-(4-acetylbenzoyl)pyridine
    参考文献:
    名称:
    Al-Shiekh, Mariam A.; El-Din, Abdellatif M. Salah; Hafez, Ebtisam A., Journal of Chemical Research - Part S, 2004, p. 174 - 179
    摘要:
    DOI:
  • 作为产物:
    描述:
    1,4-二乙酰苯N,N-二甲基甲酰胺二甲基缩醛 反应 0.05h, 以96%的产率得到trans-1-(4-acetylphenyl)-3-(dimethylamino)propenone
    参考文献:
    名称:
    Al-Shiekh, Mariam A.; El-Din, Abdellatif M. Salah; Hafez, Ebtisam A., Journal of Chemical Research - Part S, 2004, p. 174 - 179
    摘要:
    DOI:
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文献信息

  • Synthesis of Substituted 1‐Hydroxy‐2‐Naphthaldehydes by Rhodium‐Catalyzed C−H Bond Activation and Vinylene Transfer of Enaminones with Vinylene Carbonate
    作者:Min Liu、Kelu Yan、Jiangwei Wen、Weihua Liu、Mingyu Wang、Lina Wang、Xiu Wang
    DOI:10.1002/adsc.202101181
    日期:2022.2
    The rhodium(III)-catalyzed C−H bond activation and vinylene transfer of enaminones with vinylene carbonate have been proposed for the synthesis of substituted 1-hydroxy-2-naphthaldehydes in 49–84% yields. Several preliminary mechanistic studies and hydroxyl-directed derivatization reactions of 1-hydroxy-2-naphthaldehydes were also performed. This method offers an alternative approach for the synthesis
    已经提出了铑(III)催化的 C-H 键活化和烯胺酮与碳酸亚乙烯酯的亚乙烯基转移,以 49-84% 的产率合成取代的 1-羟基-2-萘醛。还进行了几项初步机理研究和 1-羟基-2-萘醛的羟基定向衍生反应。该方法为合成 1-羟基-2-萘醛提供了一种替代方法。
  • 2-Arylhydrazono-3-oxopropanals in heterocyclic synthesis: Synthesis of arylazopyrazole, arylazoisoxazole and dialkylpyridazine-5,6-dicarboxylate derivatives. New one-step synthesis of arylazopyrimidines
    作者:Mariam A. Al-Shiekh、Abdellatif M. Salah El-Din、Ebtisam A. Hafez、Mohamed H. Elnagdi
    DOI:10.1002/jhet.5570410501
    日期:2004.9
    A novel synthesis of arylpyrazole, isoxazole, dialkyl 1,6-dihydropyridazine 5,6-dicarboxylate derivatives and a new one-step synthesis of azolopyrimidines under microwave-assisted conditions are reported.
    报道了在微波辅助条件下芳基吡唑,异恶唑,1,6-二氢哒嗪二烷基5,6-二羧酸酯衍生物的新颖合成和偶氮嘧啶的新一步合成。
  • FUSED HETEROARYL MODULATORS OF GLUCOCORTICOID RECEPTOR, AP-1, AND/OR NF-kappaB ACTIVITY AND USE THEREOF
    申请人:Duan Jingwu
    公开号:US20110002952A1
    公开(公告)日:2011-01-06
    Novel non-steroidal compounds are provided which are useful in treating diseases or disorders associated with modulation of the glucocorticoid receptor, AP-1, and/or NF-κB activity, including metabolic and inflammatory and immune diseases or disorders, having the structure of formula (I): an enantiomer, diastereomer, or tautomer thereof, or a prodrug ester thereof, or a pharmaceutically-acceptable salt thereof, in which: Z is heterocyclo or heteroaryl; -A is a 5- to 8-membered carbocyclic ring or a 5- to 8-membered heterocyclic ring; B1 and B2 rings are pyridyl rings, wherein the B1 and B 2 rings are each fused to the A ring and the B1 ring is optionally substituted by one to three groups which are the same or different and are independently selected from R 1 , R 2 , and R 4 , and the B2 ring is optionally substituted by one to three groups which are the same or different and are independently selected from R3, R 7 , and R 3 71, J 2 , and J3 are at each occurrence the same or different and are independently -AIQA2-; Q is a bond, O, S, S(0), or S(O)2; A1 and A2 are the same or different and are at each occurrence independently selected from a bond, C1-3 alkylene, substituted C 1-3 alkylene, C24 alkenylene, and substituted C24 alkenylene, provided that A 1 and A2 are chosen so that ring A is a 5- to 8-membered carbocyclic or heterocyclic ring; R 1 to R 11 are as defined herein.
    提供了一种新型的非类固醇化合物,其在治疗与糖皮质激素受体、AP-1和/或NF-κB活性调节相关的疾病或疾病中具有用途,包括代谢性、炎症和免疫性疾病或疾病,其具有以下结构(I)的对映体、顺反异构体或互变异构体,或其前药酯,或其药学上可接受的盐,其中:Z是杂环或杂环芳基;-A是5-至8-成员的碳环或5-至8-成员的杂环;B1和B2环是吡啶环,其中B1和B2环各与A环融合,B1环可选地被1至3个基取代,所述基是相同或不同的,且独立地从R1、R2和R4中选择,B2环可选地被1至3个基取代,所述基是相同或不同的,且独立地从R3、R7和R371、J2和J3中选择,每次出现时,J2和J3是相同或不同的,且独立地为-AIQA2-;Q是键,O、S、S(0)或S(O)2;A1和A2是相同或不同的,且每次出现时独立地从键、C1-3烷基、取代C1-3烷基、C24烯基和取代C24烯基中选择,前提是A1和A2被选择为环A是5-至8-成员的碳环或杂环;R1至R11如本文所定义。
  • US8304539B2
    申请人:——
    公开号:US8304539B2
    公开(公告)日:2012-11-06
  • Al-Shiekh, Mariam A.; El-Din, Abdellatif M. Salah; Hafez, Ebtisam A., Journal of Chemical Research - Part S, 2004, p. 174 - 179
    作者:Al-Shiekh, Mariam A.、El-Din, Abdellatif M. Salah、Hafez, Ebtisam A.、Elnagdi, Mohamed H.
    DOI:——
    日期:——
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