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3853-80-3

3853-80-3 structural image
Product Name: (+/-)-2-ACETOXYPROPIONIC ACID
Formula: C5H8O4
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1067

COMPUTED DESCRIPTORS

Molecular Weight 132.11 g/mol
XLogP3 0.1
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 132.04225873 g/mol
Monoisotopic Mass 132.04225873 g/mol
Topological Polar Surface Area 63.6 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 129
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