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1234616-26-2,MFCD17016044
Catalog No.:AA000KJP

1234616-26-2 | 3-(3,3-Difluoro-cyclobutyl)-3-oxo-propionitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$279.00   $195.00
- +
250mg
95%
in stock  
$327.00   $229.00
- +
1g
95%
in stock  
$738.00   $517.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
Technical Information
Catalog Number:
AA000KJP
Chemical Name:
3-(3,3-Difluoro-cyclobutyl)-3-oxo-propionitrile
CAS Number:
1234616-26-2
Molecular Formula:
C7H7F2NO
Molecular Weight:
159.1334
MDL Number:
MFCD17016044
SMILES:
N#CCC(=O)C1CC(C1)(F)F
Properties
Computed Properties
 
Complexity:
220  
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0  
Defined Bond Stereocenter Count:
0  
Formal Charge:
0  
Heavy Atom Count:
11  
Hydrogen Bond Acceptor Count:
4  
Hydrogen Bond Donor Count:
0  
Isotope Atom Count:
0  
Rotatable Bond Count:
2  
Undefined Atom Stereocenter Count:
0  
Undefined Bond Stereocenter Count:
0  
XLogP3:
1  

Downstream Synthesis Route

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/26914,2013,A1Locationinpatent:Page/Pagecolumn96

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/92940,2013,A1Locationinpatent:Page/Pagecolumn35

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/26914,2013,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/92940,2013,A1

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/26914,2013,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/92940,2013,A1

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/26914,2013,A1Locationinpatent:Page/Pagecolumn96-97

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/92940,2013,A1Locationinpatent:Page/Pagecolumn36

[3]CurrentPatentAssignee:NALOTHERAPEUTICS-WO2020/172258,2020,A1Locationinpatent:Paragraph00253

[1]CurrentPatentAssignee:NALOTHERAPEUTICS-WO2020/172258,2020,A1

Literature
Quotation Request
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Additional Info:
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SDS
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Tags:1234616-26-2 Molecular Formula|1234616-26-2 MDL|1234616-26-2 SMILES|1234616-26-2 3-(3,3-Difluoro-cyclobutyl)-3-oxo-propionitrile
Catalog No.: AA000KJP
1234616-26-2,MFCD17016044
1234616-26-2 | 3-(3,3-Difluoro-cyclobutyl)-3-oxo-propionitrile
Pack Size： 100mg
Purity： 95%
in stock
$279.00 $195.00
Pack Size： 250mg
Purity： 95%
in stock
$327.00 $229.00
Pack Size： 1g
Purity： 95%
in stock
$738.00 $517.00
Quantity
- +
Add to Card
Order Now
bulk Quotation Request
Technical Information
Catalog Number: AA000KJP
Chemical Name: 3-(3,3-Difluoro-cyclobutyl)-3-oxo-propionitrile
CAS Number: 1234616-26-2
Molecular Formula: C7H7F2NO
Molecular Weight: 159.1334
MDL Number: MFCD17016044
SMILES: N#CCC(=O)C1CC(C1)(F)F
Properties
Complexity: 220  
Covalently-Bonded Unit Count: 1  
Defined Atom Stereocenter Count: 0  
Defined Bond Stereocenter Count: 0  
Formal Charge: 0  
Heavy Atom Count: 11  
Hydrogen Bond Acceptor Count: 4  
Hydrogen Bond Donor Count: 0  
Isotope Atom Count: 0  
Rotatable Bond Count: 2  
Undefined Atom Stereocenter Count: 0  
Undefined Bond Stereocenter Count: 0  
XLogP3: 1  
Downstream Synthesis Route
1425931-94-7    75-05-8    1234616-26-2 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/26914,2013,A1Locationinpatent:Page/Pagecolumn96

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/92940,2013,A1Locationinpatent:Page/Pagecolumn35

1425931-93-6    1234616-26-2 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/26914,2013,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/92940,2013,A1

23761-23-1    1234616-26-2 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/26914,2013,A1

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/92940,2013,A1

1234616-26-2    1425931-95-8 

[1]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/26914,2013,A1Locationinpatent:Page/Pagecolumn96-97

[2]CurrentPatentAssignee:ROCHEHOLDINGAG-WO2013/92940,2013,A1Locationinpatent:Page/Pagecolumn36

[3]CurrentPatentAssignee:NALOTHERAPEUTICS-WO2020/172258,2020,A1Locationinpatent:Paragraph00253

1234616-26-2    1425931-83-4 

[1]CurrentPatentAssignee:NALOTHERAPEUTICS-WO2020/172258,2020,A1

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