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107553-81-1

107553-81-1 structural image
Product Name: METHYL 4-(2-CYANOPROPAN-2-YLAMINO)BENZOATE
Formula: C12H14N2O2
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COMPUTED DESCRIPTORS

Molecular Weight 218.25 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 218.105527694 g/mol
Monoisotopic Mass 218.105527694 g/mol
Topological Polar Surface Area 62.1 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 295
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