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284474-77-7

284474-77-7 structural image
Product Name: 1,3-PROPANE-D6-DIOL
Formula: C3H2D6O2
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COMPUTED DESCRIPTORS

Molecular Weight 82.13 g/mol
XLogP3 -1
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 2
Exact Mass 82.090089969 g/mol
Monoisotopic Mass 82.090089969 g/mol
Topological Polar Surface Area 40.5 Ų
Heavy Atom Count 5
Formal Charge 0
Complexity 12.4
Isotope Atom Count 6
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