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221185-47-3

221185-47-3 structural image
Product Name: 8-METHOXY-CHROMAN-3-CARBOXYLIC ACID ETHYL ESTER
Formula: C13H16O4
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COMPUTED DESCRIPTORS

Molecular Weight 236.26 g/mol
XLogP3 2.1
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 4
Exact Mass 236.10485899 g/mol
Monoisotopic Mass 236.10485899 g/mol
Topological Polar Surface Area 44.8 Ų
Heavy Atom Count 17
Formal Charge 0
Complexity 266
Isotope Atom Count 0
Defined Atom Stereocenter Count 0
Undefined Atom Stereocenter Count 1
Defined Bond Stereocenter Count 0
Undefined Bond Stereocenter Count 0
Covalently-Bonded Unit Count 1
Compound Is Canonicalized Yes