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93952-12-6

93952-12-6 structural image
Product Name: DIETHYL PHTHALATE (RING-D4)
Formula: C12H10D4O4
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COMPUTED DESCRIPTORS

Molecular Weight 226.26 g/mol
XLogP3 2.5
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 4
Rotatable Bond Count 6
Exact Mass 226.11431591 g/mol
Monoisotopic Mass 226.11431591 g/mol
Topological Polar Surface Area 52.6 Ų
Heavy Atom Count 16
Formal Charge 0
Complexity 223
Isotope Atom Count 4
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