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2029-49-4

2029-49-4 structural image
Product Name: 3-HYDROXY-2,6-BIS(HYDROXYMETHYL)-4-PYRONE
Formula: C7H8O5
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COMPUTED DESCRIPTORS

Molecular Weight 172.13 g/mol
XLogP3 -1.2
Hydrogen Bond Donor Count 3
Hydrogen Bond Acceptor Count 5
Rotatable Bond Count 2
Exact Mass 172.03717335 g/mol
Monoisotopic Mass 172.03717335 g/mol
Topological Polar Surface Area 87 Ų
Heavy Atom Count 12
Formal Charge 0
Complexity 263
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