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Homecas156779-05-4

156779-05-4

156779-05-4 structural image
Product Name: OCTANOIC-8,8,8-D3 ACID
Formula: C8H13D3O2
Synonyms: Caprylic acid-8,8,8-d3
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COMPUTED DESCRIPTORS

Molecular Weight 147.23 g/mol
XLogP3 3
Hydrogen Bond Donor Count 1
Hydrogen Bond Acceptor Count 2
Rotatable Bond Count 6
Exact Mass 147.133859987 g/mol
Monoisotopic Mass 147.133859987 g/mol
Topological Polar Surface Area 37.3 Ų
Heavy Atom Count 10
Formal Charge 0
Complexity 89.3
Isotope Atom Count 3
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