84467-19-6,MFCD09743444
Catalog No.:AA00GOTN

84467-19-6 | 1-(3,4-Dichlorophenyl)cyclobutanecarbonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
250mg
≥95%
in stock  
$19.00   $13.00
- +
1g
97%
in stock  
$38.00   $27.00
- +
2g
97%
in stock  
$74.00   $52.00
- +
5g
97%
in stock  
$182.00   $127.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA00GOTN
Chemical Name:
1-(3,4-Dichlorophenyl)cyclobutanecarbonitrile
CAS Number:
84467-19-6
Molecular Formula:
C11H9Cl2N
Molecular Weight:
226.1019
MDL Number:
MFCD09743444
SMILES:
N#CC1(CCC1)c1ccc(c(c1)Cl)Cl
Properties
Computed Properties
 
Complexity:
264  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
1  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
1  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
3.7  

Downstream Synthesis Route

[1]Akopyan;Martirosyan;Mndzhoyan;Ter-Zakharyan;Kazaryan;Aleksanyan[PharmaceuticalChemistryJournal,2001,vol.35,#8,p.421-423]

[2]Locationinpatent:schemeortableShao,Liming;Hewitt,MichaelC.;Wang,Fengjiang;Malcolm,ScottC.;Ma,Jianguo;Campbell,JohnE.;Campbell,UnaC.;Engel,SharonR.;Spicer,NancyA.;Hardy,LarryW.;Schreiber,Rudy;Spear,KerryL.;Varney,MarkA.[BioorganicandMedicinalChemistryLetters,2011,vol.21,#5,p.1438-1441]

[1]CurrentPatentAssignee:ABBOTTLABORATORIESINC-US4522828,1985,A

[1]Patent:US2013/131036,2013,A1

[2]Patent:WO2013/62966,2013,A2

[1]Patent:US2013/131036,2013,A1.Locationinpatent:Paragraph2213;2214

[2]Patent:WO2013/62966,2013,A2.Locationinpatent:Paragraph738;739

Literature
Quotation Request
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Additional Info:
SDS
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Tags:84467-19-6 Molecular Formula|84467-19-6 MDL|84467-19-6 SMILES|84467-19-6 1-(3,4-Dichlorophenyl)cyclobutanecarbonitrile
Catalog No.: AA00GOTN
84467-19-6,MFCD09743444
84467-19-6 | 1-(3,4-Dichlorophenyl)cyclobutanecarbonitrile
Pack Size: 250mg
Purity: ≥95%
in stock
$19.00 $13.00
Pack Size: 1g
Purity: 97%
in stock
$38.00 $27.00
Pack Size: 2g
Purity: 97%
in stock
$74.00 $52.00
Pack Size: 5g
Purity: 97%
in stock
$182.00 $127.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA00GOTN
Chemical Name: 1-(3,4-Dichlorophenyl)cyclobutanecarbonitrile
CAS Number: 84467-19-6
Molecular Formula: C11H9Cl2N
Molecular Weight: 226.1019
MDL Number: MFCD09743444
SMILES: N#CC1(CCC1)c1ccc(c(c1)Cl)Cl
Properties
Complexity: 264  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 14  
Hydrogen Bond Acceptor Count: 1  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 1  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 3.7  
Downstream Synthesis Route
84467-19-6    84485-58-5 

[1]Akopyan;Martirosyan;Mndzhoyan;Ter-Zakharyan;Kazaryan;Aleksanyan[PharmaceuticalChemistryJournal,2001,vol.35,#8,p.421-423]

[2]Locationinpatent:schemeortableShao,Liming;Hewitt,MichaelC.;Wang,Fengjiang;Malcolm,ScottC.;Ma,Jianguo;Campbell,JohnE.;Campbell,UnaC.;Engel,SharonR.;Spicer,NancyA.;Hardy,LarryW.;Schreiber,Rudy;Spear,KerryL.;Varney,MarkA.[BioorganicandMedicinalChemistryLetters,2011,vol.21,#5,p.1438-1441]

84467-19-6    28049-61-8 

[1]CurrentPatentAssignee:ABBOTTLABORATORIESINC-US4522828,1985,A

89488-29-9    84467-19-6    1432051-66-5 

[1]Patent:US2013/131036,2013,A1

[2]Patent:WO2013/62966,2013,A2

89488-29-9    84467-19-6    1432493-59-8 

[1]Patent:US2013/131036,2013,A1.Locationinpatent:Paragraph2213;2214

[2]Patent:WO2013/62966,2013,A2.Locationinpatent:Paragraph738;739

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