2-(trifluoromethoxy)benzoic acid


Chemical Name: 2-(trifluoromethoxy)benzoic acid
CAS Number: 1979-29-9
Product Number: AG002B5Q(AGN-PC-0WA5GF)
Synonyms:
MDL No:
Molecular Formula: C8H5F3O3
Molecular Weight: 206.1187

Identification/Properties


Properties
MP:
78 °C
BP:
231.6°C at 760 mmHg
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
206.12g/mol
XLogP3:
2.8
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
2
Exact Mass:
206.019g/mol
Monoisotopic Mass:
206.019g/mol
Topological Polar Surface Area:
46.5A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
214
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-H319-H412
Precautionary Statements:
P273-P305+P351+P338
Class:
N/A
Packing Group:
N/A

NMR Spectrum


Other Analytical Data


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