Home Carboxys 6-(Trifluoromethyl)pyrimidine-4-carboxylic acid

6-(Trifluoromethyl)pyrimidine-4-carboxylic acid

CAS No.:
933721-99-4
Catalog Number:
AG0063OR
Molecular Formula:
C6H3F3N2O2
Molecular Weight:
192.0954
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
97%
1 week
United States
$563
- +
Product Description
Catalog Number:
AG0063OR
Chemical Name:
6-(Trifluoromethyl)pyrimidine-4-carboxylic acid
CAS Number:
933721-99-4
Molecular Formula:
C6H3F3N2O2
Molecular Weight:
192.0954
MDL Number:
MFCD09954922
IUPAC Name:
6-(trifluoromethyl)pyrimidine-4-carboxylic acid
InChI:
InChI=1S/C6H3F3N2O2/c7-6(8,9)4-1-3(5(12)13)10-2-11-4/h1-2H,(H,12,13)
InChI Key:
IGXLCQPTBOJNPW-UHFFFAOYSA-N
SMILES:
OC(=O)c1ncnc(c1)C(F)(F)F
Properties
Complexity:
207  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
192.015g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
192.097g/mol
Monoisotopic Mass:
192.015g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
63.1A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1  
Properties