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672-89-9

672-89-9 structural image
Product Name: 4-Methoxy-6-methyl-2H-pyran-2-one
Formula: C7H8O3
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CHEMICAL AND PHYSICAL PROPERTIES

Kovats Retention Index 1297

COMPUTED DESCRIPTORS

Molecular Weight 140.14 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 3
Rotatable Bond Count 1
Exact Mass 140.047344113 g/mol
Monoisotopic Mass 140.047344113 g/mol
Topological Polar Surface Area 35.5 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 213
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