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118688-56-5,MFCD01861404
Catalog No.:AA0075NN

118688-56-5 | 1,3,5-Tris(phenylethynyl)benzene

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250mg
in stock  
$104.00   $73.00
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1g
in stock  
$177.00   $124.00
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5g
in stock  
$470.00   $329.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA0075NN
Chemical Name:
1,3,5-Tris(phenylethynyl)benzene
CAS Number:
118688-56-5
Molecular Formula:
C30H18
Molecular Weight:
378.4639
MDL Number:
MFCD01861404
SMILES:
c1ccc(cc1)C#Cc1cc(C#Cc2ccccc2)cc(c1)C#Cc1ccccc1
Properties
Computed Properties
 
Complexity:
611  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
30  
Rotatable Bond Count:
6  
XLogP3:
8.8  

Downstream Synthesis Route

[1]Panda,Biswajit;Sarkar,Tarunk.[Synthesis,2013,vol.45,#6,p.817-829]

[2]Behera,PradyotaKumar;Bisoyi,Abinash;Bisoyi,Tanmayee;Choudhury,Prabhupada;Gorantla,KoteswaraRao;Mallik,BhabaniS.;Mohapatra,Manoj;Rout,Laxmidhar;Sahu,RashmiRanjan;Sahu,SantoshKumar[NewJournalofChemistry,2022,vol.46,#4,p.1650-1657]

[3]Songkram,Chalermkiat;Takaishi,Kojiro;Yamaguchi,Kentaro;Kagechika,Hiroyuki;Endo,Yasuyuki[TetrahedronLetters,2001,vol.42,#36,p.6365-6368]

[4]LandaraniIsfahani,Amir;Mohammadpoor-Baltork,Iraj;Mirkhani,Valiollah;Khosropour,AhmadR.;Moghadam,Majid;Tangestaninejad,Shahram[EuropeanJournalofOrganicChemistry,2014,vol.2014,#25,p.5603-5609]

[5]Yamaguchi,Yoshihiro;Ochi,Takanori;Miyamura,Satoshi;Tanaka,Takahiro;Kobayashi,Shigeya;Wakamiya,Tateaki;Matsubara,Yoshio;Yoshida,Zen-Ichi[JournaloftheAmericanChemicalSociety,2006,vol.128,#14,p.4504-4505]

[6]Ponzini,Francesco;Zagha,Ralph;Hardcastle,Kenneth;Siegel,JayS.[AngewandteChemie-InternationalEdition,2000,vol.39,#13,p.2323-2325]

[7]Shi,Shengyin;Zhang,Yuhong[Synlett,2007,#12,p.1843-1850]

[8]Weber,Edwin;Hecker,Manfred;Koepp,Erich;Orlia,Wolfgang;Czugler,Matyas;Csoeregh,Ingeborg[JournaloftheChemicalSociety.PerkintransactionsII,1988,p.1251-1258]

[9]Chow;Wan;Low;Yeung[JournalofOrganicChemistry,2001,vol.66,#5,p.1910-1913]

[10]Kondo,Koichi;Yasuda,Sayo;Sakaguchi,Tohoru;Miya,Masaru[JournaloftheChemicalSociety.Chemicalcommunications,1995,#1,p.55-56]

[11]Locationinpatent:experimentalpartKang,Dongjin;Eom,Dahan;Kim,Hyunseok;Lee,PhilHo[EuropeanJournalofOrganicChemistry,2010,#12,p.2330-2336]

[12]Alfuth,Jan;Chojnacki,Jarosław;Połoński,Tadeusz;Herman,Aleksander;Milewska,MariaJ.;Olszewska,Teresa[CrystalGrowthandDesign,2022,vol.22,#5,p.3493-3504]

[1]ZeitschriftfurNaturforschung,B:ChemicalSciences,1998,vol.53,p.833-835

Literature

Title: DNA melting in small-molecule-DNA-hybrid dimer structures: experimental characterization and coarse-grained molecular dynamics simulations.

Journal: The journal of physical chemistry. B 20100304

Title: Excited-state structure and dynamics of 1,3,5-tris(phenylethynyl)benzene as studied by Raman and time-resolved fluorescence spectroscopy.

Journal: The journal of physical chemistry. A 20070419

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