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272130-46-8

272130-46-8 structural image
Product Name: BENZENEACETIC ACID, 3-(HYDROXYMETHYL)-, ETHYL ESTER
Formula: C11H14O3
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COMPUTED DESCRIPTORS

Molecular Weight 194.23 g/mol
XLogP3 1.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 5
Exact Mass 194.094294304 g/mol
Monoisotopic Mass 194.094294304 g/mol
Topological Polar Surface Area 46.5 Ų
Heavy Atom Count 14
Formal Charge 0
Complexity 179
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