Home Carboxys 2-[4-(Trifluoromethoxy)phenyl]thiazole-5-carboxylic Acid

2-[4-(Trifluoromethoxy)phenyl]thiazole-5-carboxylic Acid

CAS No.:
886370-20-3
Catalog Number:
AG00IFA2
Molecular Formula:
C11H6F3NO3S
Molecular Weight:
289.2304
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Product Description
Catalog Number:
AG00IFA2
Chemical Name:
2-[4-(Trifluoromethoxy)phenyl]thiazole-5-carboxylic Acid
CAS Number:
886370-20-3
Molecular Formula:
C11H6F3NO3S
Molecular Weight:
289.2304
MDL Number:
MFCD07375334
IUPAC Name:
2-[4-(trifluoromethoxy)phenyl]-1,3-thiazole-5-carboxylic acid
InChI:
InChI=1S/C11H6F3NO3S/c12-11(13,14)18-7-3-1-6(2-4-7)9-15-5-8(19-9)10(16)17/h1-5H,(H,16,17)
InChI Key:
UULXHMJUWYLKIY-UHFFFAOYSA-N
SMILES:
OC(=O)c1cnc(s1)c1ccc(cc1)OC(F)(F)F
Properties
Complexity:
332  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
289.002g/mol
Formal Charge:
0
Heavy Atom Count:
19  
Hydrogen Bond Acceptor Count:
8  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
289.228g/mol
Monoisotopic Mass:
289.002g/mol
Rotatable Bond Count:
3  
Topological Polar Surface Area:
87.7A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.7  
Properties