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1189981-54-1

1189981-54-1 structural image
Product Name: MONO-ETHYL MALONATE-1,2,3-13C3
Formula: C5H8O4
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COMPUTED DESCRIPTORS

Molecular Weight 135.09 g/mol
XLogP3 0.3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 135.05232324 g/mol
Monoisotopic Mass 135.05232324 g/mol
Topological Polar Surface Area 63.6 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 118
Isotope Atom Count 3
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