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37960-84-2

37960-84-2 structural image
Product Name: BENZOIC-3,5-D2 ACID
Formula: C7H4D2O2
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COMPUTED DESCRIPTORS

Molecular Weight 124.13 g/mol
XLogP3 1.9
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 1
Exact Mass 124.049332922 g/mol
Monoisotopic Mass 124.049332922 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 9
Formal Charge 0
Complexity 104
Isotope Atom Count 2
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