Home Fluorides 261952-03-8
261952-03-8,MFCD01631594
Catalog No.:AA002S4M

261952-03-8 | 2-Methyl-5-(trifluoromethyl)benzonitrile

Pack Size
Purity
Availability
Price(USD)
Quantity
  
1g
98%
in stock  
$56.00   $39.00
- +
5g
96%
in stock  
$220.00   $154.00
- +
25g
96%
in stock  
$834.00   $584.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA002S4M
Chemical Name:
2-Methyl-5-(trifluoromethyl)benzonitrile
CAS Number:
261952-03-8
Molecular Formula:
C9H6F3N
Molecular Weight:
185.1458
MDL Number:
MFCD01631594
SMILES:
N#Cc1cc(ccc1C)C(F)(F)F
Properties
Properties
 
BP:
213.7°C at 760 mmHg  
Form:
Solid  
Storage:
Keep in dry area;2-8℃;  

Computed Properties
 
Complexity:
225  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
4  
XLogP3:
2.9  

Downstream Synthesis Route

[1]CurrentPatentAssignee:OREXOAB;INFLAYZMEPHARMACEUTICALS;ROTHCAROLJ-WO2006/108149,2006,A2Locationinpatent:Page/Pagecolumn38-39

[1]CurrentPatentAssignee:ABBVIEINC-WO2014/179564,2014,A1Locationinpatent:Paragraph00180

Literature
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Additional Info:
SDS
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