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4433-82-3

4433-82-3 structural image
Product Name: BUTANOIC ACID, 2-ACETYL-3-OXO-
Formula: C6H8O4
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COMPUTED DESCRIPTORS

Molecular Weight 144.12 g/mol
XLogP3 -0.4
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 144.04225873 g/mol
Monoisotopic Mass 144.04225873 g/mol
Topological Polar Surface Area 71.4 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 168
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