2-Thiazolecarboxylicacid, 4-(trifluoromethyl)-


Chemical Name: 2-Thiazolecarboxylicacid, 4-(trifluoromethyl)-
CAS Number: 944900-55-4
Product Number: AG003KC0(AGN-PC-01ZKRP)
Synonyms:
MDL No: MFCD07377490
Molecular Formula: C5H2F3NO2S
Molecular Weight: 197.1351

Identification/Properties


Properties
BP:
294.305 °C at 760 mmHg
Storage:
2-8℃;Keep in dry area;
Computed Properties
Molecular Weight:
197.131g/mol
XLogP3:
1.7
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
7
Rotatable Bond Count:
1
Exact Mass:
196.976g/mol
Monoisotopic Mass:
196.976g/mol
Topological Polar Surface Area:
78.4A^2
Heavy Atom Count:
12
Formal Charge:
0
Complexity:
196
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:
Signal Word:
Warning
UN#:
N/A
Hazard Statements:
H302-H315-H319-H335
Precautionary Statements:
P261-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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