Home Carboxys 5-(Trifluoromethyl)-2-(4-(trifluoromethyl)phenyl)oxazole-4-carboxylic acid

5-(Trifluoromethyl)-2-(4-(trifluoromethyl)phenyl)oxazole-4-carboxylic acid

CAS No.:
886497-47-8
Catalog Number:
AG008A4Q
Molecular Formula:
C12H5F6NO3
Molecular Weight:
325.1634
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
1 week
United States
$121
- +
1g
1 week
United States
$281
- +
Product Description
Catalog Number:
AG008A4Q
Chemical Name:
5-(Trifluoromethyl)-2-(4-(trifluoromethyl)phenyl)oxazole-4-carboxylic acid
CAS Number:
886497-47-8
Molecular Formula:
C12H5F6NO3
Molecular Weight:
325.1634
MDL Number:
MFCD06245517
IUPAC Name:
5-(trifluoromethyl)-2-[4-(trifluoromethyl)phenyl]-1,3-oxazole-4-carboxylic acid
InChI:
InChI=1S/C12H5F6NO3/c13-11(14,15)6-3-1-5(2-4-6)9-19-7(10(20)21)8(22-9)12(16,17)18/h1-4H,(H,20,21)
InChI Key:
AOEAEYCNEQBSCN-UHFFFAOYSA-N
SMILES:
OC(=O)c1nc(oc1C(F)(F)F)c1ccc(cc1)C(F)(F)F
Properties
Complexity:
416  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
325.017g/mol
Formal Charge:
0
Heavy Atom Count:
22  
Hydrogen Bond Acceptor Count:
10  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
325.166g/mol
Monoisotopic Mass:
325.017g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
63.3A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties