Home Carboxys 3-(2,2,2-trifluoroethoxy)pyridine-2-carboxylic acid

3-(2,2,2-trifluoroethoxy)pyridine-2-carboxylic acid

CAS No.:
1250130-41-6
Catalog Number:
AG019YSE
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
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Product Description
Catalog Number:
AG019YSE
Chemical Name:
3-(2,2,2-trifluoroethoxy)pyridine-2-carboxylic acid
CAS Number:
1250130-41-6
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
MDL Number:
MFCD14653038
IUPAC Name:
3-(2,2,2-trifluoroethoxy)pyridine-2-carboxylic acid
InChI:
InChI=1S/C8H6F3NO3/c9-8(10,11)4-15-5-2-1-3-12-6(5)7(13)14/h1-3H,4H2,(H,13,14)
InChI Key:
ZYVCUJPSTZGVCU-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncccc1OCC(F)(F)F
Properties
Complexity:
232  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
221.03g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.135g/mol
Monoisotopic Mass:
221.03g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.8  
Properties