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99168-49-7

99168-49-7 structural image
Product Name: 2-(ALLYLTHIO)-4-AMINO-5-PYRIMIDINECARBOXYLIC ACID ETHYL ESTER
Formula: C10H13N3O2S
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COMPUTED DESCRIPTORS

Molecular Weight 239.30 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 6
Exact Mass 239.07284784 g/mol
Monoisotopic Mass 239.07284784 g/mol
Topological Polar Surface Area 103 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 250
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