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2931-90-0

2931-90-0 structural image
Product Name: 4-hydroxy-5-methoxyisophthalaldehyde
Formula: C9H8O4
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COMPUTED DESCRIPTORS

Molecular Weight 180.16 g/mol
XLogP3 0.8
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 3
Exact Mass 180.04225873 g/mol
Monoisotopic Mass 180.04225873 g/mol
Topological Polar Surface Area 63.6 Ų
Heavy Atom Count 13
Formal Charge 0
Complexity 192
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