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29107-30-0

29107-30-0 structural image
Product Name: 3,3-BIS(HYDROXYMETHYL)-2,3-DIHYDRO-4H-THIOCHROMEN-4-ONE
Formula: C11H12O3S
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COMPUTED DESCRIPTORS

Molecular Weight 224.28 g/mol
XLogP3 1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 2
Exact Mass 224.05071541 g/mol
Monoisotopic Mass 224.05071541 g/mol
Topological Polar Surface Area 82.8 Ų
Heavy Atom Count 15
Formal Charge 0
Complexity 250
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