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75942-37-9,MFCD00134586
Catalog No.:AA005T8N

75942-37-9 | 3,6-Dibutoxy-1,2-benzenedicarbonitrile

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250mg
97%
in stock  
$24.00   $17.00
- +
1g
97%
in stock  
$63.00   $44.00
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5g
97%
in stock  
$195.00   $137.00
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  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA005T8N
Chemical Name:
3,6-Dibutoxy-1,2-benzenedicarbonitrile
CAS Number:
75942-37-9
Molecular Formula:
C16H20N2O2
Molecular Weight:
272.3422
MDL Number:
MFCD00134586
SMILES:
CCCCOc1ccc(c(c1C#N)C#N)OCCCC
Properties
Properties
 
Form:
Solid  

Computed Properties
 
Complexity:
329  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
8  
XLogP3:
3.8  

Downstream Synthesis Route

[1]Durka,Krzysztof;Górski,Bartosz;Błocki,Krzysztof;Urban,Mateusz;Woźniak,Krzysztof;Barbasiewicz,Michał;Luliński,Sergiusz[JournalofPhysicalChemistryA,2019,vol.123,#40,p.8674-8689]

[2]Cook,MichaelJ.;Dunn,AdrianJ.;Howe,StevenD.;Thomson,AndrewJ.;Harrison,KennethJ.[JournaloftheChemicalSociety.PerkintransactionsI,1988,p.2453-2458]

[1]McKearney,Declan;Zhou,Wen;Zellman,Carson;Williams,VanceE.;Leznoff,DanielB.[ChemicalCommunications,2019,vol.55,#47,p.6696-6699]

[2]Chikamatsu,Tatsuki;Furuyama,Taniyuki;Horikawa,Takafumi;Maeda,Hajime;Segi,Masahito;Taima,Tetsuya;Takahashi,Hiromi;Uchiyama,Shiori[RSCAdvances,2020,vol.10,#52,p.31348-31354]

[3]Furuyama,Taniyuki;Uchiyama,Shiori;Iwamoto,Takayuki;Maeda,Hajime;Segi,Masahito[JournalofPorphyrinsandPhthalocyanines,2018,vol.22,#1-3,p.88-94]

[4]Rihter,BorisD.;Kenney,MalcolmE.;Ford,WilliamE.;Rodgers,MichaelA.J.[JournaloftheAmericanChemicalSociety,1990,vol.112,#22,p.8064-8070]

[5]Cook,MichaelJ.;Dunn,AdrianJ.;Howe,StevenD.;Thomson,AndrewJ.;Harrison,KennethJ.[JournaloftheChemicalSociety.PerkintransactionsI,1988,p.2453-2458]

[6]Lin,Mei-Jin;Wang,Jun-Dong[JournalofMolecularStructure,2007,vol.837,#1-3,p.284-289]

[1]Michel;Goldberg;Stern;Barrett;Hoffman[JournaloftheAmericanChemicalSociety,2001,vol.123,#20,p.4741-4748]

[2]Hanack,Michael;Haberroth,Klaus;Rack,Michael[ChemischeBerichte,1993,vol.126,#5,p.1201-1204]

[1]Aoudia,Mohamed;Cheng,Gongzhen;Kennedy,VanceO.;Kenney,MalcolmE.;Rodgers,MichaelA.J.[JournaloftheAmericanChemicalSociety,1997,vol.119,#26,p.6029-6039]

[1]Aoudia,Mohamed;Cheng,Gongzhen;Kennedy,VanceO.;Kenney,MalcolmE.;Rodgers,MichaelA.J.[JournaloftheAmericanChemicalSociety,1997,vol.119,#26,p.6029-6039]

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Tags:75942-37-9 Molecular Formula|75942-37-9 MDL|75942-37-9 SMILES|75942-37-9 3,6-Dibutoxy-1,2-benzenedicarbonitrile