methyl 4-[4-fluoro-3-(trifluoromethyl)phenyl]benzoate


Chemical Name: methyl 4-[4-fluoro-3-(trifluoromethyl)phenyl]benzoate
CAS Number: 1365271-42-6
Product Number: AG0011ZA(AGN-PC-0J2C6J)
Synonyms:
MDL No:
Molecular Formula: C15H10F4O2
Molecular Weight: 298.2323

Identification/Properties


Computed Properties
Molecular Weight:
298.237g/mol
XLogP3:
4.4
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
6
Rotatable Bond Count:
3
Exact Mass:
298.062g/mol
Monoisotopic Mass:
298.062g/mol
Topological Polar Surface Area:
26.3A^2
Heavy Atom Count:
21
Formal Charge:
0
Complexity:
361
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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