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


Chemical Name: 2-(3-fluorophenyl)-1,3-thiazole-4-carboxylic acid
CAS Number: 886369-06-8
Product Number: AG00GS51(AGN-PC-04HB51)
Synonyms:
MDL No:
Molecular Formula: C10H6FNO2S
Molecular Weight: 223.2235

Identification/Properties


Computed Properties
Molecular Weight:
223.221g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
2
Exact Mass:
223.01g/mol
Monoisotopic Mass:
223.01g/mol
Topological Polar Surface Area:
78.4A^2
Heavy Atom Count:
15
Formal Charge:
0
Complexity:
252
Isotope Atom Count:
0
Defined Atom Stereocenter Count:
0
Undefined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
Covalently-Bonded Unit Count:
1
Compound Is Canonicalized:
Yes

Safety Information


GHS Pictogram:
N/A
Signal Word:
UN#:
-
Hazard Statements:
-
Precautionary Statements:
Class:
-
Packing Group:
-

NMR Spectrum


Other Analytical Data


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