Home Other Building Blocks 2-(2,2,2-TRIFLUOROETHYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID

2-(2,2,2-TRIFLUOROETHYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID

CAS No.:
1179338-11-4
Catalog Number:
AG01DV1F
Molecular Formula:
C6H4F3NO2S
Molecular Weight:
211.1617
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
Product Description
Catalog Number:
AG01DV1F
Chemical Name:
2-(2,2,2-TRIFLUOROETHYL)-1,3-THIAZOLE-4-CARBOXYLIC ACID
CAS Number:
1179338-11-4
Molecular Formula:
C6H4F3NO2S
Molecular Weight:
211.1617
MDL Number:
MFCD14656951
IUPAC Name:
2-(2,2,2-trifluoroethyl)-1,3-thiazole-4-carboxylic acid
InChI:
InChI=1S/C6H4F3NO2S/c7-6(8,9)1-4-10-3(2-13-4)5(11)12/h2H,1H2,(H,11,12)
InChI Key:
DICGJUGOJVDBRD-UHFFFAOYSA-N
SMILES:
OC(=O)c1csc(n1)CC(F)(F)F
Properties
Complexity:
209  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
210.991g/mol
Formal Charge:
0
Heavy Atom Count:
13  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
211.158g/mol
Monoisotopic Mass:
210.991g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.2  
Properties