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56913-55-4

56913-55-4 structural image
Product Name: TETRAETHYL 1,1'-(1,1'-BIPHENYL-4,4'-DIYL)BIS(2,5-DIMETHYL-1 H-PYRROLE-3,4-DICARBOXYLATE)
Formula: C36H40N2O8
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COMPUTED DESCRIPTORS

Molecular Weight 628.7 g/mol
XLogP3 6.8
Hydrogen Bond Donor Count 0
Hydrogen Bond Acceptor Count 8
Rotatable Bond Count 15
Exact Mass 628.27846624 g/mol
Monoisotopic Mass 628.27846624 g/mol
Topological Polar Surface Area 115 Ų
Heavy Atom Count 46
Formal Charge 0
Complexity 911
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