Benzoic acid, 3-fluoro-4-(trifluoromethyl)-


Chemical Name: Benzoic acid, 3-fluoro-4-(trifluoromethyl)-
CAS Number: 115754-21-7
Product Number: AG000GU2(AGN-PC-0JUYM6)
Synonyms:
MDL No: MFCD00236279
Molecular Formula: C8H4F4O2
Molecular Weight: 208.1098

Identification/Properties


Properties
MP:
174-179 °C(lit.)
BP:
251℃
Storage:
Keep in dry area;Room Temperature;
Form:
Solid
Computed Properties
Molecular Weight:
208.112g/mol
XLogP3:
2.4
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
1
Exact Mass:
208.015g/mol
Monoisotopic Mass:
208.015g/mol
Topological Polar Surface Area:
37.3A^2
Heavy Atom Count:
14
Formal Charge:
0
Complexity:
226
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


NMR Spectrum


Other Analytical Data


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