Home Carboxys 2-(M-Tolylamino)-4-(trifluoromethyl)thiazole-5-carboxylic acid

2-(M-Tolylamino)-4-(trifluoromethyl)thiazole-5-carboxylic acid

CAS No.:
886502-96-1
Catalog Number:
AG00JEZ6
Molecular Formula:
C12H9F3N2O2S
Molecular Weight:
302.2723
Pack Size
Purity
Availability
Location
Price(USD)
Quantity
  
500mg
1 week
United States
$571
- +
1g
1 week
United States
$727
- +
Product Description
Catalog Number:
AG00JEZ6
Chemical Name:
2-(M-Tolylamino)-4-(trifluoromethyl)thiazole-5-carboxylic acid
CAS Number:
886502-96-1
Molecular Formula:
C12H9F3N2O2S
Molecular Weight:
302.2723
MDL Number:
MFCD06739367
IUPAC Name:
2-(3-methylanilino)-4-(trifluoromethyl)-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C12H9F3N2O2S/c1-6-3-2-4-7(5-6)16-11-17-9(12(13,14)15)8(20-11)10(18)19/h2-5H,1H3,(H,16,17)(H,18,19)
InChI Key:
RGKWMNAJAJLAOZ-UHFFFAOYSA-N
SMILES:
Cc1cccc(c1)Nc1sc(c(n1)C(F)(F)F)C(=O)O
Properties
Complexity:
367  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
302.034g/mol
Formal Charge:
0
Heavy Atom Count:
20  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
2  
Isotope Atom Count:
0
Molecular Weight:
302.271g/mol
Monoisotopic Mass:
302.034g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
90.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
4  
Properties