找化学品上960化工网!
960化工网

1,2-二苯基环丙烯-3-酮 | 886-38-4

1,2-二苯基环丙烯-3-酮
Diphenylcyclopropenone
886-38-4
C15H10O
206.239304065704
如需查看该化合物的详细结构式,mol文件,smile,InChi 请点击:1,2-二苯基环丙烯-3-酮结构式
24850631
简介
Diphenylcyclopropenone (Diphencyprone) 是一种局部免疫调节剂,可用于斑秃的研究。
名称和标识符
MDL MFCD00001311
InChIKey HCIBTBXNLVOFER-UHFFFAOYSA-N
Inchi 1S/C15H10O/c16-15-13(11-7-3-1-4-8-11)14(15)12-9-5-2-6-10-12/h1-10H
SMILES O=C1C(C2C=CC=CC=2)=C1C1C=CC=CC=1
BRN 608049
别名信息
- 中文别名 -
  • 1,2-二苯基环丙烯-3-酮
  • 二苯基环丙烯酮
  • 2,3-二苯基-2-环丙烯-1-酮
- 英文别名 -
  • Diphenylcyclopropenone
  • Diphencyprone
  • DPC
  • 2,3-Diphenyl-2-cyclopropen-1-one
  • 1,2-DIPHENYLCYCLOPROPEN-3-ONE
  • 2,3-diphenylcycloprop-2-en-1-one
  • 2,3-Diphenylcycloprop-2-enone
  • 2,3-Diphenylcyclopropenone
  • Diphencyclopropenone
  • 1,2-Diphenylcyclopropenone
  • 2-Cyclopropen-1-one, 2,3-diphenyl-
  • Cyclopropenone, diphenyl-
  • DPCP
  • Cyclopropenone, 2,3-diphenyl-
  • I7G14NW5EC
  • Diphenylcyclopropenone, 98%
  • diphenylcycloprop-2-en-1-one
  • HCIBTBXNLVOFER-UHFFFAOYSA-N
  • CPD000449319
  • DS
  • 2,3-Diphenyl-2-cyclopropen-1-one (ACI)
  • Cyclopropenone, diphenyl- (6CI, 7CI, 8CI)
  • 2,3-Diphenyl-cycloprop-2-enone
  • Diphenyl cyclopropenone
  • NSC 57541
物化性质
实验特性
LogP 3.18010
PSA 17.07000
Merck 14,3308
折射率 1.6324 (estimate)
沸点 305.09°C (rough estimate)
熔点 118-122 °C (lit.)
闪点 182.7 °C
颜色与性状 未确定
溶解性 未确定
密度 1.232
计算特性
精确分子量 206.07300
氢键供体数量 0
氢键受体数量 1
可旋转化学键数量 2
同位素质量 206.073
重原子数量 16
复杂度 284
同位素原子数量 0
确定原子立构中心数量 0
不确定原子立构中心数量 0
确定化学键立构中心数量 0
不确定化学键立构中心数量 0
共价键单元数量 1
疏水参数计算参考值(XlogP) 3.3
互变异构体数量
表面电荷 0
拓扑分子极性表面积 17.1
国际标准相关数据
EINECS 57541
海关数据
海关编码 29142990
合成路线

合成路线:1 步

反应条件:
参考文献:
Synthesis of diphenylcyclopropenone
Breslow, Ronald; Haynie, Robert; Mirra, Joseph, Journal of the American Chemical Society, 1959, 81, 247-8

合成路线:1 步

反应条件:
参考文献:
Aromatic cation activation of alcohols: conversion to alkyl chlorides using dichlorodiphenylcyclopropene
Kelly, Brendan D.; Lambert, Tristan H., Journal of the American Chemical Society, 2009, 131(39), 13930-13931

合成路线:1 步

反应条件:
参考文献:
Iron-Catalyzed One-Step Synthesis of Isothiazolone/1,2-Selenazolone Derivatives via [3+1+1] Annulation of Cyclopropenones, Anilines, and Elemental Chalcogens
Wang, Hongchen; Yan, Rulong, Advanced Synthesis & Catalysis, 2022, 364(4), 715-719

合成路线:1 步

参考文献:
Strain assisted α-cleavage reactions of thio ketones: diphenylcyclopropenethione
Singh, Sharat; Bhadbhade, M. M.; Venkatesan, K.; Ramamurthy, V., Journal of Organic Chemistry, 1982, 47(18), 3550-3

合成路线:1 步

反应条件:
参考文献:
Cyclopropenium-Activated Cyclodehydration of Diols
Kelly, Brendan D.; Lambert, Tristan H., Organic Letters, 2011, 13(4), 740-743

合成路线:1 步

反应条件:
参考文献:
Divergent Synthesis of Tetrasubstituted Phenols via [3 + 3] Cycloaddition Reaction of Vinyl Sulfoxonnium Ylides with Cyclopropenones
Chen, Shao-Yong; Zeng, Yao-Fu ; Zou, Wen-Xuan; Shen, Dan-Ting; Zheng, Yi-Chuan; et al, Organic Letters, 2023, 25(23), 4286-4291

合成路线:1 步

反应条件:
参考文献:
Cyclopropenone oximes. Preparation and reaction with isocyanates
Yoshida, Hiroshi; Ohtsuka, Hideki; Yoshida, Keisuke; Totani, Yoshiyuki; Ogata, Tsuyoshi; et al, Bulletin of the Chemical Society of Japan, 1988, 61(12), 4347-51

合成路线:1 步

反应条件:
参考文献:
Cascade Ring-Opening Dual Halogenation of Cyclopropenones with Saturated Oxygen Heterocycles
Miao, Wei-Hang; Gao, Wen-Xia ; Huang, Xiao-Bo; Liu, Miao-Chang ; Zhou, Yun-Bing ; et al, Organic Letters, 2021, 23(24), 9425-9430

合成路线:1 步

反应条件:
参考文献:
Gas-phase synthesis of hydrodiphenylcyclopropenylium via nonclassical Favorskii rearrangement from alkali-cationized α,α'-dibromodibenzyl ketone
Zhao, Zhi-Xiong; Wang, Hao-Yang; Xu, Chu; Guo, Yin-Long, Rapid Communications in Mass Spectrometry, 2010, 24(17), 2665-2672

合成路线:1 步

反应条件:
参考文献:
Palladium-Catalyzed C-C Bond Activation of Cyclopropenone: Modular Access to Trisubstituted α,β-Unsaturated Esters and Amides
Nanda, Tanmayee ; Biswal, Pragati; Pati, Bedadyuti Vedvyas; Banjare, Shyam Kumar; Ravikumar, Ponneri Chandrababu, Journal of Organic Chemistry, 2021, 86(3), 2682-2695

合成路线:1 步

反应条件:
参考文献:
A Palladium-Catalyzed Cascade C-C Activation of Cyclopropenone and Carbonylative Amination: Easy Access to Highly Functionalized Maleimide Derivatives
Nanda, Tanmayee ; Ravikumar, P. C., Organic Letters, 2020, 22(4), 1368-1374

合成路线:1 步

反应条件:
参考文献:
Synthesis, characterization, and oxidation electrochemistry of some novel 1,2-dithiol-3-ones and 1,2-dithiol-3-thiones containing aryl and metallocenyl fragments
Sanchez Garcia, Jessica J.; Joo-Cisneros, Rene S.; Garcia-Bassoco, David; Flores-Alamo, Marcos ; Stivalet, Jose M. Mendez; et al, Journal of Organometallic Chemistry, 2021, 944,

合成路线:1 步

反应条件:
参考文献:
Synthesis of cyclopropenones by a modified Favorskii reaction
Breslow, Ronald; Posner, Judd; Krebs, Adolf, Journal of the American Chemical Society, 1963, 85,

合成路线:1 步

反应条件:
参考文献:
Cyclopropenone Catalyzed Substitution of Alcohols with Mesylate Ion
Nacsa, Eric D.; Lambert, Tristan H., Organic Letters, 2013, 15(1), 38-41

合成路线:1 步

反应条件:
参考文献:
Alkyne and Reversible Nitrile Activation: N,N'-Diamidocarbene-Facilitated Synthesis of Cyclopropenes, Cyclopropenones, and Azirines
Moerdyk, Jonathan P.; Bielawski, Christopher W., Journal of the American Chemical Society, 2012, 134(14), 6116-6119

合成路线:1 步

反应条件:
参考文献:
Rh(III)-Catalyzed [3 + 3] Annulation Reaction of Cyclopropenones and Sulfoxonium Ylides toward Trisubstituted 2-Pyrones
Zhou, Peng; Yang, Wei-Tao; Rahman, Anis Ur; Li, Guigen ; Jiang, Bo, Journal of Organic Chemistry, 2020, 85(2), 360-366

合成路线:1 步

反应条件:
参考文献:
Polysubstituted pyrrole derivatives via 1,2-alkenyl migration of novel γ-amino-α,β-unsaturated aldehydes and α-diazocarbonyls
Cai, Shuting; Zeng, Jing; Li, Yongxin; Liu, Xue-Wei, RSC Advances, 2014, 4(14), 7275-7278

合成路线:1 步

反应条件:
参考文献:
Deconstructive Cycloaromatization Strategy toward N,O-Bidentate Ligands from Indolizines and Cyclopropenones
Zhou, Jinlei; Shi, Xiaotian; Zheng, Huitao; Chen, Guangxian; Zhang, Chen; et al, Organic Letters, 2022, 24(17), 3238-3243

合成路线:1 步

反应条件:
参考文献:
Diphenylcyclopropenone
Breslow, Ronald; Eicher, Theo; Krebs, Adolf; Peterson, Ruth A.; Posner, Judd, Journal of the American Chemical Society, 1965, 87(6), 1320-5

合成路线:1 步

反应条件:
参考文献:
Diphenylcyclopropenone
Breslow, R.; Posner, J., Organic Syntheses, 1967, 47, 62-3
相关文献
专业数据库参考
PubChemId 24850631
参考资料
Beilstein 608049
化合物详情(旧版)

SMILES

C1=CC=C(C=C1)C2=C(C3=CC=CC=C3)C2=O

960化工网为您提供1,2-二苯基环丙烯-3-酮专业化合物百科信息,包括中文名,英文名,分子式,分子量,以及该化合物的CasNo.:886-38-4,和相关理化性质;并提供了优质生产厂家信息包括厂家名称和联系方式等;| WAP 版:886-38-4
平台客服 平台客服

平台在线客服