Home Carboxys 2-Trifluoromethylthiazole-5-carboxylic acid ethyl ester

2-Trifluoromethylthiazole-5-carboxylic acid ethyl ester

CAS No.:
131748-96-4
Catalog Number:
AG000ZOP
Molecular Formula:
C7H6F3NO2S
Molecular Weight:
225.1882
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
97%
In Stock USA
United States
$69
- +
5g
97%
In Stock USA
United States
$282
- +
10g
97%
In Stock USA
United States
$513
- +
Product Description
Catalog Number:
AG000ZOP
Chemical Name:
2-Trifluoromethylthiazole-5-carboxylic acid ethyl ester
CAS Number:
131748-96-4
Molecular Formula:
C7H6F3NO2S
Molecular Weight:
225.1882
MDL Number:
MFCD09055619
IUPAC Name:
ethyl 2-(trifluoromethyl)-1,3-thiazole-5-carboxylate
InChI:
InChI=1S/C7H6F3NO2S/c1-2-13-5(12)4-3-11-6(14-4)7(8,9)10/h3H,2H2,1H3
InChI Key:
KQTWGECEHUVSPX-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1cnc(s1)C(F)(F)F
Properties
Complexity:
222  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
225.007g/mol
Formal Charge:
0
Heavy Atom Count:
14  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
225.185g/mol
Monoisotopic Mass:
225.007g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.4  
Properties