Home Other Building Blocks 3-Fluoro-5-(trifluoromethyl)picolinic acid

3-Fluoro-5-(trifluoromethyl)picolinic acid

CAS No.:
172527-71-8
Catalog Number:
AG00AZG5
Molecular Formula:
C13H13ClF3NO4
Molecular Weight:
339.6948
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
95%
1 week
United States
$288
- +
Product Description
Catalog Number:
AG00AZG5
Chemical Name:
3-Fluoro-5-(trifluoromethyl)picolinic acid
CAS Number:
172527-71-8
Molecular Formula:
C13H13ClF3NO4
Molecular Weight:
339.6948
MDL Number:
MFCD00231883
IUPAC Name:
diethyl 2-[3-chloro-5-(trifluoromethyl)pyridin-2-yl]propanedioate
InChI:
InChI=1S/C13H13ClF3NO4/c1-3-21-11(19)9(12(20)22-4-2)10-8(14)5-7(6-18-10)13(15,16)17/h5-6,9H,3-4H2,1-2H3
InChI Key:
VRPNAVYQHJYROG-UHFFFAOYSA-N
SMILES:
CCOC(=O)C(c1ncc(cc1Cl)C(F)(F)F)C(=O)OCC
Properties
Complexity:
387  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
339.049g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
339.695g/mol
Monoisotopic Mass:
339.049g/mol
Rotatable Bond Count:
7  
Topological Polar Surface Area:
65.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3  
Properties