Home Carboxys 2-(propan-2-yloxy)-6-(trifluoromethyl)pyridine-3-carboxylic acid

2-(propan-2-yloxy)-6-(trifluoromethyl)pyridine-3-carboxylic acid

CAS No.:
1506745-64-7
Catalog Number:
AG01BDWJ
Molecular Formula:
C10H10F3NO3
Molecular Weight:
249.1865
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Product Description
Catalog Number:
AG01BDWJ
Chemical Name:
2-(propan-2-yloxy)-6-(trifluoromethyl)pyridine-3-carboxylic acid
CAS Number:
1506745-64-7
Molecular Formula:
C10H10F3NO3
Molecular Weight:
249.1865
MDL Number:
MFCD23356360
IUPAC Name:
2-propan-2-yloxy-6-(trifluoromethyl)pyridine-3-carboxylic acid
InChI:
InChI=1S/C10H10F3NO3/c1-5(2)17-8-6(9(15)16)3-4-7(14-8)10(11,12)13/h3-5H,1-2H3,(H,15,16)
InChI Key:
LPTFRCQWMJZSCV-UHFFFAOYSA-N
SMILES:
CC(Oc1nc(ccc1C(=O)O)C(F)(F)F)C
Properties
Complexity:
281  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
249.061g/mol
Formal Charge:
0
Heavy Atom Count:
17  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
249.189g/mol
Monoisotopic Mass:
249.061g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
59.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties