methyl 3-(6-aminopyridin-3-yl)-5-fluorobenzoate


Chemical Name: methyl 3-(6-aminopyridin-3-yl)-5-fluorobenzoate
CAS Number: 1314987-71-7
Product Number: AG000WCT(AGN-PC-0BGIIT)
Synonyms:
MDL No:
Molecular Formula: C13H11FN2O2
Molecular Weight: 246.2370

Identification/Properties


Computed Properties
Molecular Weight:
246.241g/mol
XLogP3:
2.1
Hydrogen Bond Donor Count:
1
Hydrogen Bond Acceptor Count:
5
Rotatable Bond Count:
3
Exact Mass:
246.08g/mol
Monoisotopic Mass:
246.08g/mol
Topological Polar Surface Area:
65.2A^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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