92866-00-7 (4-乙炔基二苯乙炔,1-Ethynyl-4-(phenylethynyl)benzene)

快速询单

结构式：

4-乙炔基二苯乙炔MOL文件

CAS号：

92866-00-7

中文名称：

4-乙炔基二苯乙炔

英文名称：

1-Ethynyl-4-(phenylethynyl)benzene

安全信息：

分子式：

C₁₆H₁₀

分子量：

202.250604152679

4-乙炔基二苯乙炔(92866-00-7)名称与标识符

名称

中文别名：

1-乙炔基-4-(苯乙炔基)苯;1-Ethynyl-4-(phenylethynyl)benzene 1-乙炔基-4-(苯乙炔基)苯;4-苯乙炔基苯乙炔;4-乙炔基二苯乙炔;1-(4-乙炔苯基)-2-苯乙炔;

英文别名：

Benzene, 1-ethynyl-4-(phenylethynyl)-;1-Ethynyl-4-(phenylethynyl)benzene;1-ethynyl-4-(2-phenylethynyl)benzene;4-Ethynyldiphenylacetylene;1-(4-Ethynylphenyl)-2-phenylacetylene;4-(phenylethynyl)phenylacetylene;[4-(Phenylethynyl)phenyl]ethyne;WAUKYPQSFIENDE-UHFFFAOYSA-N;E0967;1-Ethynyl-4-(2-phenylethynyl)benzene (ACI);Benzene, 1-ethynyl-4-(phenylethynyl)- (7CI, 9CI);[p-(Phenylethynyl)phenyl]acetylene;p-Ethynyltolane;YSWG397;CS-0169895;DTXSID60460868;T73075;AKOS030228731;MFCD27665710;SY056503;92866-00-7;AS-61834;1-Ethynyl-4-phenylethynyl-benzene;

标识符

MDL：

MFCD27665710

InChIKey：

WAUKYPQSFIENDE-UHFFFAOYSA-N

Inchi：

1S/C16H10/c1-2-14-8-10-16(11-9-14)13-12-15-6-4-3-5-7-15/h1,3-11H

SMILES：

C#CC1C=CC(C#CC2C=CC=CC=2)=CC=1

4-乙炔基二苯乙炔(92866-00-7)物化性质

实验特性

熔点 : 88.0 to 92.0 deg-C
最大波长(λmax) : 318(Benzene)(lit.)

计算特性

精确分子量 : 202.078250319g/mol
氢键供体数量 : 0
氢键受体数量 : 0
可旋转化学键数量 : 3
同位素质量 : 202.078250319g/mol
重原子数量 : 16
复杂度 : 315
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） : 5
拓扑分子极性表面积 : 0

4-乙炔基二苯乙炔(92866-00-7)安全信息

符号： GHS07
危害声明：H315-H319
警示性声明：P264-P280-P302+P352+P332+P313+P362+P364-P305+P351+P338+P337+P313
提示语：警告

4-乙炔基二苯乙炔(92866-00-7)推荐厂家更多厂家(13)

公司名称	手机号/电话	联系人	QQ	询单
上海源叶生物科技有限公司	15026964105 15026964105	汤思磊	2881489226	询单
郑州阿尔法化工有限公司	15324716602 0371-55013243	刘经理	2853979810	询单
上海创赛科技有限公司	15021221957 021-59553580	凌度	2852351983	询单
上海绩祥生物科技有限公司	13093077543	陆经理	3985448220	询单
上海瀚思化工有限公司	18939883912 021-34536277	顾经理	3003949364	询单
上海腾准生物科技有限公司	19821570922 021-34053661	张经理	3003871136	询单
JACS-郑州杰克斯化工产品有限公司	15981966935 0371-86259281	杰克斯JACS	893596907	询单
江苏艾康生物医药研发有限公司	18795912720 025-66061636	杨情情	3004779232	询单
上海吉至生化科技有限公司	18117592386 021-57481218	吉至试剂	3007522982	询单
梯希爱（上海）化成工业发展有限公司	13061970904	张泽原	862682778	询单

4-乙炔基二苯乙炔(92866-00-7)合成路线

合成路线：1 步

147492-76-0

_99%

92866-00-7

反应条件：

1.1 Reagents: Potassium carbonate Solvents: Methanol ; rt

参考文献：

Chemoselective Synthesis of 1,1-Disubstituted Vinyl Triflates from Terminal Alkynes Using TfOH in the Presence of TMSN3

Tummatorn, Jumreang ; Punjajom, Kunlayanee; Rodphon, Warabhorn; Ruengsangtongkul, Sureeporn; Chaisan, Nattawadee; et al, Organic Letters, 2019, 21(12), 4694-4697

合成路线：1 步

147492-76-0

_98%

92866-00-7

反应条件：

1.1 Reagents: Potassium carbonate Solvents: Methanol , Tetrahydrofuran ; 6 h, rt

参考文献：

Self-assembled nanostructures of linear arylacetylenes and their aza-substituted analogues

Xu, Jia-Ju; Yang, Xiong-Bo; Feng, Hua; Wang, Yu-Long; Shan, Hai-Quan; et al, AIP Advances, 2016, 6(6),

合成路线：1 步

1070319-00-4

_98%

92866-00-7

反应条件：

1.1 Catalysts: Methanol , Tetrabutylammonium hydroxide Solvents: Toluene ; 5 min, 75 °C

参考文献：

A rapid and efficient synthetic route to terminal arylacetylenes by tetrabutylammonium hydroxide and methanol-catalyzed cleavage of 4-aryl-2-methyl-3-butyn-2-ols

Li, Jie; Huang, Pengcheng, Beilstein Journal of Organic Chemistry, 2011, 7, 426-431

合成路线：1 步

147492-76-0

_96%

92866-00-7

反应条件：

1.1 Reagents: Potassium carbonate Solvents: Methanol , Tetrahydrofuran ; 4 h, rt

参考文献：

Fluoro-substituted phenyleneethynylenes: acetylenic n-type organic semiconductors

Matsuo, Daisuke; Yang, Xin; Hamada, Akiko; Morimoto, Kyo; Kato, Takuji; et al, Chemistry Letters, 2010, 39(12), 1300-1302

合成路线：1 步

147492-76-0

_96%

92866-00-7

反应条件：

1.1 Reagents: Potassium carbonate Solvents: Methanol , Dichloromethane ; overnight, rt

参考文献：

Combinatorial synthesis of oligo(phenylene ethynylene)s

Hwang, Jiunn-Jye; Tour, James M., Tetrahedron, 2002, 58(52), 10387-10405

合成路线：1 步

1070319-00-4

_95%

92866-00-7

反应条件：

1.1 Reagents: Tetrabutylammonium hydroxide Solvents: Methanol , Toluene ; 1 h, 75 °C
1.2 Reagents: Acetic acid ; neutralized

参考文献：

Novel monomers applicable to a compensation film, an optical film, and a display device

, United States, , ,

合成路线：1 步

147492-76-0

_94%

92866-00-7

反应条件：

1.1 Reagents: Potassium fluoride Solvents: Methanol , Dichloromethane ; 6 h, rt

参考文献：

Enhanced Emission in Self-Assembled Phenyleneethynylene Derived π-Gelators

Das, Gourab ; Thirumalai, Rajasekaran; Vedhanarayanan, Balaraman ; Praveen, Vakayil K. ; Ajayaghosh, Ayyappanpillai, Advanced Optical Materials, 2020, 8(14),

合成路线：1 步

147492-76-0

_93%

92866-00-7

反应条件：

1.1 Reagents: Potassium carbonate Solvents: Methanol , Water ; rt → 50 °C; 50 °C

参考文献：

Dielectric polymer compositions containing phenylactylene (di)adamantane monomer for microelectronic applications

, World Intellectual Property Organization, , ,

合成路线：1 步

147492-76-0

_93%

92866-00-7

反应条件：

1.1 Reagents: Potassium carbonate Solvents: Methanol ; rt → 50 °C; 3 h, 50 °C; cooled
1.2 Solvents: Dichloromethane ; 30 min, cooled

参考文献：

Compositions and methods for thermosetting acetylenic monomers in organic compositions

, United States, , ,

合成路线：1 步

147492-76-0

_92%

92866-00-7

反应条件：

1.1 Reagents: Potassium carbonate Solvents: Methanol , Tetrahydrofuran ; 1.5 h, rt

参考文献：

Synthesis and spectroscopic studies of arylethynylsilanes

Shao, Guang; Orita, Akihiro; Nishijima, Koji; Ishimaru, Kanako; Takezaki, Makoto; et al, Chemistry - An Asian Journal, 2007, 2(4), 489-498

合成路线：1 步

147492-76-0

_92%

92866-00-7

反应条件：

1.1 Reagents: Potassium carbonate Solvents: Methanol , Dichloromethane ; overnight, rt

参考文献：

Multiple self-assembled nanostructures from an oligo(p-phenyleneethynylene) containing rod-coil-rod triblock copolymer

Li, Kun; Wang, Qing, Chemical Communications (Cambridge, 2005, (38), 4786-4788

合成路线：1 步

1070319-00-4

_91%

92866-00-7

反应条件：

1.1 Reagents: Sodium hydroxide Solvents: Toluene , 1,2-Dimethoxyethane ; 2 h, 70 °C

参考文献：

Process for the preparation of substituted phenylacetylenes via deprotection of 2-methyl-4-aryl-3-butyn-2-ols

, China, , ,

合成路线：1 步

147492-76-0

_91%

92866-00-7

反应条件：

1.1 Reagents: Potassium carbonate Solvents: Methanol , Dichloromethane ; rt
1.2 Reagents: Water

参考文献：

Three-terminal field-controlled molecular devices

, World Intellectual Property Organization, , ,

合成路线：1 步

147492-76-0

_88%

92866-00-7

反应条件：

1.1 Reagents: Potassium hydroxide Solvents: Methanol , Dichloromethane ; rt; 12 h, rt

参考文献：

Synthesis of a Homopolymer of Oligo(p-phenyleneethynylene) Attached to Alternate Carbons of a Main Chain Polyethylene and Its Liquid-Crystalline and Optical Properties

Wang, Wen-Zhong; Huang, Peng-Cheng, Journal of Macromolecular Science, 2013, 52(5), 701-715

合成路线：1 步

1066-54-2

766-96-1

_87%

92866-00-7

反应条件：

1.1 Reagents: Triethylamine Catalysts: Cuprous iodide , Dichlorobis(triphenylphosphine)palladium ; 7 h, rt
1.2 Reagents: Potassium hydroxide Solvents: Methanol , Chloroform , Water ; 0.5 h, rt

参考文献：

New fluorophores with rod-shaped polycyano π-conjugated structures: Synthesis and photophysical properties

Yamaguchi, Yoshihiro; Ochi, Takanori; Wakamiya, Tateaki; Matsubara, Yoshio; Yoshida, Zen-Ichi, Organic Letters, 2006, 8(4), 717-720

合成路线：1 步

7608-18-6

766-96-1

_82%

92866-00-7

反应条件：

1.1 Reagents: Potassium tert-butoxide , Tributylmethoxystannane Solvents: Tetrahydrofuran ; 4.5 h, reflux
1.2 Catalysts: Tri-tert-butylphosphine , Tris(dibenzylideneacetone)dipalladium ; 8 h, rt

参考文献：

A one-pot method for the synthesis of phenylalkynyl-substituted terminal alkynes by deprotection/stannylation followed by a Migita-Kosugi-Stille coupling

Peng, Li-fen; Wang, Bing-hao; Wang, Ming; Tang, Zi-long; Jiang, Yan-zi; et al, Journal of Chemical Research, 2018, 42(5), 235-238

合成路线：1 步

147492-76-0

_80%

92866-00-7

反应条件：

1.1 Reagents: Sodium hydroxide Solvents: Ethanol , Tetrahydrofuran

参考文献：

Selective and efficient access to ortho, meta and para ring-substituted phenylacetylene derivatives R-[CC-C6H4]x-Y (Y = H, NO2, CN, I, NH2)

Lavastre, Olivier; Cabioch, Sandrine; Dixneuf, Pierre H.; Vohlidal, Jiri, Tetrahedron, 1997, 53(22), 7595-7604

合成路线：1 步

13667-12-4

1066-54-2

_78%

92866-00-7

反应条件：

1.1 Reagents: Triethylamine Catalysts: Cuprous iodide , Dichlorobis(triphenylphosphine)palladium ; 24 h, 80 °C
1.2 Reagents: Ammonium chloride Solvents: Water
1.3 Reagents: Tetrabutylammonium fluoride Solvents: Tetrahydrofuran ; 0 °C; 0 °C → rt; 1 h, rt
1.4 Reagents: Ammonium chloride Solvents: Water ; rt

参考文献：

Cu(I) catalysis for selective condensation/bicycloaromatization of two different arylalkynes: direct and general construction of functionalized C-N axial biaryl compounds

Shang, Qian; Tang, Haifang; Liu, Yongping; Yin, MingMing; Su, Lebin; et al, Chemical Science, 2022, 13(1), 263-273

合成路线：1 步

7608-18-6

766-99-4

_77%

92866-00-7

反应条件：

1.1 Reagents: Tributylmethoxystannane Catalysts: Potassium tert-butoxide Solvents: Tetrahydrofuran ; 5 h, reflux; reflux → rt
1.2 Catalysts: Tri-tert-butylphosphine , Tris(dibenzylideneacetone)dipalladium Solvents: Tetrahydrofuran ; rt

参考文献：

One-Pot Transformation of Ph2P(O)-Protected Ethynes: Deprotection Followed by Transition Metal-Catalyzed Coupling

Peng, Lifen; Xu, Feng; Suzuma, Yoshinori; Orita, Akihiro; Otera, Junzo, Journal of Organic Chemistry, 2013, 78(24), 12802-12808

合成路线：1 步

147492-76-0

_70%

92866-00-7

反应条件：

1.1 Catalysts: Tetrabutylammonium fluoride Solvents: Tetrahydrofuran ; rt; 3 h, rt
1.2 Reagents: Water

参考文献：

Investigation of poly(phenylacetylene) derivatives for carbon precursor with high carbon yield and good solubility

Sengeh, Joseph Vandy; Agboola, Olumide D.; Li, Houxiang; Zhu, Wei; Mike Chung, T. C., European Polymer Journal, 2021, 147,