Home Halogens Ethyl 2-chloro-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate

Ethyl 2-chloro-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate

CAS No.:
72850-52-3
Catalog Number:
AG00FBA9
Molecular Formula:
C7H5ClF3NO2S
Molecular Weight:
259.6333
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
250mg
98%
1 week
United States
$281
- +
1g
98%
1 week
United States
$524
- +
Product Description
Catalog Number:
AG00FBA9
Chemical Name:
Ethyl 2-chloro-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate
CAS Number:
72850-52-3
Molecular Formula:
C7H5ClF3NO2S
Molecular Weight:
259.6333
MDL Number:
MFCD02956778
IUPAC Name:
ethyl 2-chloro-4-(trifluoromethyl)-1,3-thiazole-5-carboxylate
InChI:
InChI=1S/C7H5ClF3NO2S/c1-2-14-5(13)3-4(7(9,10)11)12-6(8)15-3/h2H2,1H3
InChI Key:
RLZUPBSTNNZDDH-UHFFFAOYSA-N
SMILES:
CCOC(=O)c1sc(nc1C(F)(F)F)Cl
Properties
Complexity:
251  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
258.968g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
259.627g/mol
Monoisotopic Mass:
258.968g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
67.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.4  
Properties