Home Fluorides 946409-32-1
946409-32-1,MFCD09972206
Catalog No.:AA00INI6

946409-32-1 | 3-[5-(trifluoromethyl)pyridin-2-yl]benzoic acid

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Technical Information
Catalog Number:
AA00INI6
Chemical Name:
3-[5-(trifluoromethyl)pyridin-2-yl]benzoic acid
CAS Number:
946409-32-1
Molecular Formula:
C13H8F3NO2
Molecular Weight:
267.2033
MDL Number:
MFCD09972206
SMILES:
OC(=O)c1cccc(c1)c1ccc(cn1)C(F)(F)F
Properties
Computed Properties
 
Complexity:
332  
Covalently-Bonded Unit Count:
1  
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
6  
Hydrogen Bond Donor Count:
1  
Rotatable Bond Count:
2  
XLogP3:
2.9  

Literature
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SDS
Tags:946409-32-1 Molecular Formula|946409-32-1 MDL|946409-32-1 SMILES|946409-32-1 3-[5-(trifluoromethyl)pyridin-2-yl]benzoic acid