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952182-51-3,MFCD09836051
Catalog No.:AA00IIRI

952182-51-3 | 2-(Trifluoromethyl)quinoline-6-carboxylic acid

Pack Size
Purity
Availability
Price(USD)
Quantity
  
100mg
95%
in stock  
$195.00   $137.00
- +
250mg
95%
in stock  
$324.00   $227.00
- +
1g
95%
in stock  
$1,040.00   $728.00
- +
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
  • Request for Quotation
  • Download SDS
  • Technical Information
  • Properties
  • Downstream Synthesis Route
  • Literature
Technical Information
Catalog Number:
AA00IIRI
Chemical Name:
2-(Trifluoromethyl)quinoline-6-carboxylic acid
CAS Number:
952182-51-3
Molecular Formula:
C11H6F3NO2
Molecular Weight:
241.1660
MDL Number:
MFCD09836051
SMILES:
OC(=O)c1ccc2c(c1)ccc(n2)C(F)(F)F
Properties
Computed Properties
 
Complexity:
306  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
1  
XLogP3:
2.6  

Downstream Synthesis Route
952182-51-3   
1-(1,5-dimethyl-1H-pyrazol-4-yl)ethanaminedihydrochlohde 
  1027329-88-9 

[1]CurrentPatentAssignee:EVOTECAG;PFIZERINC-WO2008/59370,2008,A2Locationinpatent:Page/Pagecolumn79

[1]CurrentPatentAssignee:EVOTECAG;PFIZERINC-WO2008/59370,2008,A2Locationinpatent:Page/Pagecolumn66

[1]CurrentPatentAssignee:EVOTECAG;PFIZERINC-WO2008/59370,2008,A2Locationinpatent:Page/Pagecolumn75-76

952182-51-3   
(S)-1-(1-methyl-5-(trifluoromethyl)-1H-pyrazol-4-yl)ethanaminedihydrochloride 
  1027329-84-5 

[1]CurrentPatentAssignee:EVOTECAG;PFIZERINC-WO2008/59370,2008,A2Locationinpatent:Page/Pagecolumn77

[1]CurrentPatentAssignee:BAYERAG-WO2011/9540,2011,A2

Literature
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SDS
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Tags:952182-51-3 Molecular Formula|952182-51-3 MDL|952182-51-3 SMILES|952182-51-3 2-(Trifluoromethyl)quinoline-6-carboxylic acid