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98061-21-3

98061-21-3 structural image
Product Name: METHYL 4-(2-PYRIDINYL)BENZOATE
Formula: C13H11NO2
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COMPUTED DESCRIPTORS

Molecular Weight 213.23 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 3
Exact Mass 213.078978594 g/mol
Monoisotopic Mass 213.078978594 g/mol
Topological Polar Surface Area 39.2 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 234
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