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20778-47-6,MFCD10687162
Catalog No.:AA002J7G

20778-47-6 | 1,1-Cyclopropanediacetonitrile

Pack Size
Purity
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Price(USD)
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250mg
93%
in stock  
$244.00   $171.00
- +
1g
93%
in stock  
$535.00   $374.00
- +
5g
93%
in stock  
$1,504.00   $1,053.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002J7G
Chemical Name:
1,1-Cyclopropanediacetonitrile
CAS Number:
20778-47-6
Molecular Formula:
C7H8N2
Molecular Weight:
120.1518
MDL Number:
MFCD10687162
SMILES:
N#CCC1(CC1)CC#N
Properties
Computed Properties
 
Complexity:
175  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
9  
Hydrogen Bond Acceptor Count:
2  
Rotatable Bond Count:
2  
XLogP3:
0.6  

Downstream Synthesis Route

[1]ComptesRendusHebdomadairesdesSeancesdel'AcademiedesSciences,1962,vol.254,p.313-315

[1]Foos,J.etal.[JournalofOrganicChemistry,1979,vol.44,#14,p.2522-2529]

[2]CurrentPatentAssignee:SINOCHEMHOLDINGSCORPORATIONLTD;Syngenta(in:SinochemHoldings)-EP2336104,2011,A1Locationinpatent:Page/Pagecolumn127

[3]Gore,Vivek;Gravel,Sylvie;Cossette,Chantal;Patel,Pranav;Chourey,Shishir;Ye,Qiuji;Rokach,Joshua;Powell,WilliamS.[JournalofMedicinalChemistry,2014,vol.57,#2,p.364-377]

[4]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2014/39203,2014,A1Locationinpatent:Paragraph0067-0071

[5]Ye,Qiuji;Chourey,Shishir;Wang,Rui;Chintam,NagendraReddy;Gravel,Sylvie;Powell,WilliamS.;Rokach,Joshua[BioorganicandMedicinalChemistryLetters,2017,vol.27,#20,p.4770-4776]

[6]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-WO2014/20038,2014,A1Locationinpatent:Page/Pagecolumn12;13

[1]Tetrahedron,2014,vol.70,p.975-983

[1]Tetrahedron,2014,vol.70,p.975-983

[1]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2014/39203,2014,A1

[2]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2014/39203,2014,A1

[3]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-US2014/39203,2014,A1

[4]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-WO2014/20038,2014,A1

[5]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-WO2014/20038,2014,A1

[6]CurrentPatentAssignee:C.H.BoehringerSohnAG&Co.KG-WO2014/20038,2014,A1

Literature
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SDS
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Tags:20778-47-6 Molecular Formula|20778-47-6 MDL|20778-47-6 SMILES|20778-47-6 1,1-Cyclopropanediacetonitrile