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54090-85-6

54090-85-6 structural image
Product Name: UROPORPHYRIN I ETHYL ESTER
Formula: C56H70N4O16
Synonyms: 21H,23H-Porphine-2,7,12,17-tetrapropanoic acid, 3,8,13,18-tetrakis(2-ethoxy-2-oxoethyl)-, tetraethyl ester
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COMPUTED DESCRIPTORS

Molecular Weight 943.0 g/mol
XLogP3 1.8
Hydrogen Bond Donor Count 6
Hydrogen Bond Acceptor Count 18
Rotatable Bond Count 28
Exact Mass 942.35348165 g/mol
Monoisotopic Mass 942.35348165 g/mol
Topological Polar Surface Area 312 Ų
Heavy Atom Count 68
Formal Charge 0
Complexity 1770
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