Home Carboxys 3-(4-fluorophenyl)-1,2-thiazole-5-carboxylic acid

3-(4-fluorophenyl)-1,2-thiazole-5-carboxylic acid

CAS No.:
1486096-34-7
Catalog Number:
AG01EBFD
Molecular Formula:
C10H6FNO2S
Molecular Weight:
223.2235
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Product Description
Catalog Number:
AG01EBFD
Chemical Name:
3-(4-fluorophenyl)-1,2-thiazole-5-carboxylic acid
CAS Number:
1486096-34-7
Molecular Formula:
C10H6FNO2S
Molecular Weight:
223.2235
MDL Number:
MFCD21304963
IUPAC Name:
3-(4-fluorophenyl)-1,2-thiazole-5-carboxylic acid
InChI:
InChI=1S/C10H6FNO2S/c11-7-3-1-6(2-4-7)8-5-9(10(13)14)15-12-8/h1-5H,(H,13,14)
InChI Key:
KLFSXVLSWICGTA-UHFFFAOYSA-N
SMILES:
Fc1ccc(cc1)c1nsc(c1)C(=O)O
Properties
Complexity:
244  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.01g/mol
Formal Charge:
0
Heavy Atom Count:
15  
Hydrogen Bond Acceptor Count:
5  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
223.221g/mol
Monoisotopic Mass:
223.01g/mol
Rotatable Bond Count:
2  
Topological Polar Surface Area:
78.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
2.6  
Properties