methyl 3-fluoro-5-(3-fluoropyridin-2-yl)benzoate


Chemical Name: methyl 3-fluoro-5-(3-fluoropyridin-2-yl)benzoate
CAS Number: 1365273-04-6
Product Number: AG00121G(AGN-PC-0J2C96)
Synonyms:
MDL No:
Molecular Formula: C13H9F2NO2
Molecular Weight: 249.2129

Identification/Properties


Computed Properties
Molecular Weight:
249.217g/mol
XLogP3:
2.6
Hydrogen Bond Donor Count:
0
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
249.06g/mol
Monoisotopic Mass:
249.06g/mol
Topological Polar Surface Area:
39.2A^2
Heavy Atom Count:
18
Formal Charge:
0
Complexity:
301
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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