14182-01-5 ((E)-2-甲基-1,3-二苯基-2-丙烯-1-酮,2-Propen-1-one, 2-methyl-1,3-diphenyl-, (2E)-)

CAS号:
14182-01-5
中文名称:
(E)-2-甲基-1,3-二苯基-2-丙烯-1-酮
英文名称:
2-Propen-1-one, 2-methyl-1,3-diphenyl-, (2E)-
分子式:
C16H14O
分子量:
222.28176

(E)-2-甲基-1,3-二苯基-2-丙烯-1-酮(14182-01-5)名称与标识符

名称

英文别名:
2-Propen-1-one,2-methyl-1,3-diphenyl-, (2E)-;(E)-2-methyl-1,3-diphenylprop-2-en-1-one;(2E)-2-methyl-1,3-diphenylprop-2-en-1-one;(E)-2-Methyl-1,3-diphenyl-2-propen-1-on;(E)-2-Methyl-1,3-diphenyl-2-propen-1-one;3-iodo-(E)-but-2-en-1-ol;CTK3J8617;diphenyl-1,3 methyl-2 propene-2 one-1;trans-2-methyl-1,3-dipheny;4258-37-1;MLS003106952;NSC185338;NSC-185338;NSC224125;14182-01-5;CHEMBL5083193;(E)-alpha-Methyl-beta-phenylacrylophenone;NSC401989;NSC-224125;NSC-401989;2-Benzylidene-1-phenylpropanal;2-Propen-1-one, 2-methyl-1,3-diphenyl-, (E)-;Chalcone, α-methyl-, (E)- (8CI);(2E)-2-Methyl-1,3-diphenyl-2-propen-1-one;NSC 185338;

标识符

InChIKey:
DKKXNYQFLLVEHQ-OUKQBFOZSA-N
Inchi:
InChI=1S/C16H14O/c1-13(12-14-8-4-2-5-9-14)16(17)15-10-6-3-7-11-15/h2-12H,1H3/b13-12+
SMILES:
C1C=CC=CC=1C(/C(/C)=C/C1C=CC=CC=1)=O

(E)-2-甲基-1,3-二苯基-2-丙烯-1-酮(14182-01-5)物化性质

实验特性

  • LogP : 3.97280
  • PSA : 17.07
  • 折射率 : 1.611
  • 沸点 : 354.1°Cat760mmHg
  • 闪点 : 152.7°C
  • 密度 : 1.078

计算特性

  • 精确分子量 : 222.10452
  • 氢键供体数量 : 0
  • 氢键受体数量 : 1
  • 可旋转化学键数量 : 3
  • 同位素质量 : 222.104
  • 重原子数量 : 17
  • 复杂度 : 278
  • 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 : 1
  • 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) : 4.1
  • 拓扑分子极性表面积 : 17.1A^2

(E)-2-甲基-1,3-二苯基-2-丙烯-1-酮(14182-01-5)推荐厂家 更多厂家(1)

公司名称手机号/电话联系人QQ微信询单
上海楷森生物科技有限公司 17558870519
175-58870519
赵经理 3003926540
询单

(E)-2-甲基-1,3-二苯基-2-丙烯-1-酮(14182-01-5)合成路线

合成路线:1 步
反应条件:
参考文献:
Intramolecular oxidative C-N bond formation under metal-free conditions: One-pot global functionalization of pyrazole ring
By Tiwari, Mohit K. et al, Tetrahedron, 2022, 126, 133059
合成路线:1 步
反应条件:
参考文献:
A facile metal-free one-flask synthesis of multi-substituted furans via a BF3·Et2O mediated formal [4 + 1] reaction of 3-chloro-3-phenyldiazirines and α,β-alkenyl ketones
By Zhang, Zixin et al, RSC Advances, 2022, 12(24), 15190-15195
合成路线:1 步
反应条件:
参考文献:
Design, Synthesis, and Biological Evaluation of Organic Nitrite (NO2-) Donors as Potential Anticerebral Ischemia Agents
By Wu, Jianbing et al, Journal of Medicinal Chemistry, 2021, 64(15), 10919-10933
合成路线:1 步
反应条件:
参考文献:
Iridium-catalyzed enantioconvergent hydrogenation of trisubstituted olefins
By Peters, Bram B. C. et al, Nature Communications, 2022, 13(1), 361
合成路线:1 步
反应条件:
参考文献:
Manganese(I) catalyzed cross-coupling of secondary allylic alcohols and primary alcohols
By Pandia, Biplab Keshari et al, Tetrahedron, 2021, 101, 132472
合成路线:1 步
反应条件:
参考文献:
Substituent-Controlled Divergent Cascade Cycloaddition Reactions of Chalcones and Arylalkynols: Access to Spiroketals and Oxa-Bridged Fused Heterocycles
By Zeng, Tianlong et al, Advanced Synthesis & Catalysis, 2021, 363(16), 4024-4032
合成路线:3 步
反应条件:
参考文献:
Highly enantioselective iridium-catalyzed hydrogenation of conjugated trisubstituted enones
By Peters, Bram B. C. et al, Organic Letters, 2021, 23(1), 242-246
合成路线:1 步
反应条件:
参考文献:
Chemoselective Reduction of α,β-Unsaturated Carbonyl and Carboxylic Compounds by Hydrogen Iodide
By Matsumoto, Shoji et al, Bulletin of the Chemical Society of Japan, 2021, 94(2), 590-599
合成路线:1 步
反应条件:
参考文献:
New photochromic α-methylchalcones are highly photostable, even under singlet oxygen conditions: breaking the α-methyl Michael-system reactivity by reversible peroxybiradical formation
By Griesbeck, Axel G. et al, Molecules, 2021, 26(3), 642
合成路线:1 步
反应条件:
参考文献:
H-*BEA Zeolite-Catalyzed Nucleophilic Substitution in Allyl Alcohols Using Sulfonamides, Amides, and Anilines
By Ohtsuki, Akimichi et al, European Journal of Organic Chemistry, 2020, 2020(28), 4309-4318
合成路线:1 步
反应条件:
参考文献:
Oxovanadium(V)-catalyzed deoxygenative homocoupling reaction of alcohols
By Sakuramoto, Takashi et al, New Journal of Chemistry, 2019, 43(45), 17571-17576
合成路线:1 步
反应条件:
参考文献:
Stereodivergent Access to Enantioenriched Epoxy Alcohols with Three Stereogenic Centers via Ruthenium-Catalyzed Transfer Hydrogenation
By Zhao, Zhifei et al, Organic Letters, 2019, 21(14), 5491-5494
合成路线:1 步
反应条件:
参考文献:
Proton-Coupled Electron Transfer: Transition-Metal-Free Selective Reduction of Chalcones and Alkynes Using Xanthate/Formic Acid
By Prasanna, Ramanathan et al, Organic Letters, 2019, 21(8), 2650-2653
合成路线:1 步
反应条件:
参考文献:
Chalcone and cinnamate synthesis via one-pot enol silane formation-Mukaiyama aldol reactions of ketones and acetate esters
By Downey, C. Wade et al, Tetrahedron Letters, 2018, 59(32), 3080-3083
合成路线:1 步
反应条件:
参考文献:
α,β-Diaryl unsaturated ketones via palladium-catalyzed ring-opening of cyclopropenones with organoboronic acids
By Shan, Lidong et al, Organic Chemistry Frontiers, 2018, 5(10), 1651-1654
合成路线:1 步
反应条件:
参考文献:
Synthesis and biological evaluation of α-methyl-chalcone for anti-cervical cancer activity
By Ren, Bing-zhao et al, Medicinal Chemistry Research, 2017, 26(9), 1871-1883
合成路线:1 步
反应条件:
参考文献:
CBr4 as a Halogen Bond Donor Catalyst for the Selective Activation of Benzaldehydes to Synthesize α,β-Unsaturated Ketones
By Kazi, Imran et al, Organic Letters, 2017, 19(5), 1244-1247
合成路线:1 步
反应条件:
参考文献:
Zinc-Catalyzed Enantioselective Hydrosilylation of Ketones and Imines under Solvent-Free Conditions
By Szewczyk, Marcin et al, ChemCatChem, 2016, 8(23), 3575-3579
合成路线:1 步
反应条件:
参考文献:
Barluenga's reagent with HBF4 as an efficient catalyst for alkyne-carbonyl metathesis of unactivated alkynes
By Murai, Kosuke et al, Organic & Biomolecular Chemistry, 2016, 14(44), 10352-10356
合成路线:1 步
反应条件:
参考文献:
Synthesis of α,β-unsaturated ketones from alkynes and aldehydes over Hβ zeolite under solvent-free conditions
By Mameda, Naresh et al, RSC Advances, 2016, 6(63), 58137-58141
合成路线:1 步
反应条件:
参考文献:
Regioselective Synthesis of Enones via a Titanium-Promoted Coupling of Unsymmetrical Alkynes with Weinreb Amides
By Silwal, Sajan and Rahaim, Ronald J., Journal of Organic Chemistry, 2014, 79(17), 8469-8476
合成路线:1 步
反应条件:
参考文献:
Tin(II) Chloride Mediated Coupling Reactions between Alkynes and Aldehydes
By Masuyama, Yoshiro et al, European Journal of Organic Chemistry, 2013, 2013(35), 8033-8038
合成路线:1 步
反应条件:
参考文献:
Practical metal-free synthesis of chalcone derivatives via a tandem cross-dehydrogenative-coupling/elimination reaction
By Wei, Yu et al, Green Chemistry, 2013, 15(11), 3165-3169
合成路线:1 步
反应条件:
参考文献:
InCl3/Me3SiCl-Catalyzed Direct Michael Addition of Enol Acetates to α,β-Unsaturated Ketones
By Onishi, Yoshiharu et al, Organic Letters, 2012, 14(22), 5788-5791
合成路线:1 步
反应条件:
参考文献:
Synthesis of Tri- and Tetrasubstituted Pyrazoles via Ru(II) Catalysis: Intramolecular Aerobic Oxidative C-N Coupling
By Hu, Jiantao et al, Organic Letters, 2012, 14(19), 5030-5033
合成路线:1 步
反应条件:
参考文献:
The diastereoselective alkylation of β-silyl enolates
By Waterson, David, No pp.; 1984, 1984, , From No pp.
合成路线:1 步
反应条件:
参考文献:
Indium(III)-catalyzed coupling between alkynes and aldehydes to α,β-unsaturated ketones
By Miura, Katsukiyo et al, Chemistry Letters, 2010, 39(7), 766-767
合成路线:1 步
反应条件:
参考文献:
Rhodium catalyzed reaction of internal alkynes with organoborons under CO atmosphere: a product tunable reaction
By Artok, Levent et al, Tetrahedron, 2009, 65(45), 9125-9133
合成路线:1 步
反应条件:
参考文献:
Highly enantioselective synthesis of optically active ketones by iridium-catalyzed asymmetric hydrogenation
By Lu, Sheng-Mei and Bolm, Carsten, Angewandte Chemie, 2008, 47(46), 8920-8923