Home Carboxys 4-(Trifluoromethyl)thiazole-2-carboxylic acid

4-(Trifluoromethyl)thiazole-2-carboxylic acid

CAS No.:
944900-55-4
Catalog Number:
AG003KC0
Molecular Formula:
C5H2F3NO2S
Molecular Weight:
197.1351
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
1g
98%
In Stock USA
United States
$125
- +
5g
98%
In Stock USA
United States
$438
- +
Product Description
Catalog Number:
AG003KC0
Chemical Name:
4-(Trifluoromethyl)thiazole-2-carboxylic acid
CAS Number:
944900-55-4
Molecular Formula:
C5H2F3NO2S
Molecular Weight:
197.1351
MDL Number:
MFCD07377490
IUPAC Name:
4-(trifluoromethyl)-1,3-thiazole-2-carboxylic acid
InChI:
InChI=1S/C5H2F3NO2S/c6-5(7,8)2-1-12-3(9-2)4(10)11/h1H,(H,10,11)
InChI Key:
UJIAFLBUSAICKJ-UHFFFAOYSA-N
SMILES:
OC(=O)c1scc(n1)C(F)(F)F
Properties
Complexity:
196  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
196.976g/mol
Formal Charge:
0
Heavy Atom Count:
12  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
197.131g/mol
Monoisotopic Mass:
196.976g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
1.7  
Properties