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914225-20-0

914225-20-0 structural image
Product Name: 1,4-Benzenedicarboxylic acid, 2-ethoxy-, 1-ethyl ester
Formula: C12H14O5
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COMPUTED DESCRIPTORS

Molecular Weight 238.24 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 6
Exact Mass 238.08412354 g/mol
Monoisotopic Mass 238.08412354 g/mol
Topological Polar Surface Area 72.8 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 276
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