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91915-04-7

91915-04-7 structural image
Product Name: Ethanedioic acid, 1-butyl 2-(2-propen-1-yl) ester
Formula: C9H14O4
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COMPUTED DESCRIPTORS

Molecular Weight 186.20 g/mol
XLogP3 2.4
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 7
Exact Mass 186.08920892 g/mol
Monoisotopic Mass 186.08920892 g/mol
Topological Polar Surface Area 52.6 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 196
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 0
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 1
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes