Home Carboxys Methyl 2-hydroxy-5-(trifluoromethyl)pyridine-4-carboxylate

Methyl 2-hydroxy-5-(trifluoromethyl)pyridine-4-carboxylate

CAS No.:
1227594-84-4
Catalog Number:
AG00HGXC
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$250
- +
5g
98%
In Stock USA
United States
$900
- +
Product Description
Catalog Number:
AG00HGXC
Chemical Name:
Methyl 2-hydroxy-5-(trifluoromethyl)pyridine-4-carboxylate
CAS Number:
1227594-84-4
Molecular Formula:
C8H6F3NO3
Molecular Weight:
221.1333
MDL Number:
MFCD16611630
IUPAC Name:
methyl 2-oxo-5-(trifluoromethyl)-1H-pyridine-4-carboxylate
InChI:
InChI=1S/C8H6F3NO3/c1-15-7(14)4-2-6(13)12-3-5(4)8(9,10)11/h2-3H,1H3,(H,12,13)
InChI Key:
VXGVIOWBIBBZRZ-UHFFFAOYSA-N
SMILES:
COC(=O)c1cc(O)ncc1C(F)(F)F
Properties
Complexity:
368  
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:
6  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
221.135g/mol
Monoisotopic Mass:
221.03g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
55.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
0.2  
Properties