Home Fluorides 29786-44-5
29786-44-5,MFCD11036721
Catalog No.:AA00CF88

29786-44-5 | 1-(4-(Trifluoromethyl)phenyl)cyclobutanecarbonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
50mg
95%
3 weeks  
$192.00   $134.00
- +
100mg
95%
3 weeks  
$231.00   $162.00
- +
250mg
95%
3 weeks  
$279.00   $195.00
- +
500mg
95%
3 weeks  
$375.00   $263.00
- +
1g
95%
3 weeks  
$449.00   $314.00
- +
2.5g
95%
3 weeks  
$817.00   $572.00
- +
5g
95%
3 weeks  
$1,495.00   $1,047.00
- +
10g
95%
3 weeks  
$2,467.00   $1,727.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
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  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00CF88
Chemical Name:
1-(4-(Trifluoromethyl)phenyl)cyclobutanecarbonitrile
CAS Number:
29786-44-5
Molecular Formula:
C12H10F3N
Molecular Weight:
225.2097
MDL Number:
MFCD11036721
SMILES:
N#CC1(CCC1)c1ccc(cc1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
300  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
4  
Rotatable Bond Count:
1  
XLogP3:
3.3  

Downstream Synthesis Route

[1]CurrentPatentAssignee:CHONGKUNDANGHOLDINGSCORP.-KR2017/43091,2017,ALocationinpatent:Paragraph1592-1595

[2]CurrentPatentAssignee:ABBVIEINC-US2013/131036,2013,A1Locationinpatent:Paragraph1875;1876

[3]CurrentPatentAssignee:ABBVIEINC-WO2013/62966,2013,A2Locationinpatent:Paragraph400;401

[4]CurrentPatentAssignee:MERCK&COINC-WO2015/96651,2015,A1Locationinpatent:Page/Pagecolumn43;44

[5]CurrentPatentAssignee:PFIZERINC-US3526656,1970,A[Chem.Abstr.,1970,vol.73,#109539][Chem.Abstr.,1970,vol.73,#109539]

[6]Chen,Xiang;Chen,Lili;Zhao,Hongliang;Gao,Qian;Shen,Zhenlu;Xu,Senmiao[ChineseJournalofChemistry,2020,vol.38,#12,p.1533-1537]

Literature
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SDS
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Tags:29786-44-5 Molecular Formula|29786-44-5 MDL|29786-44-5 SMILES|29786-44-5 1-(4-(Trifluoromethyl)phenyl)cyclobutanecarbonitrile