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1263-63-4

1263-63-4 structural image
Product Name: MESOPORPHYRIN IX DIMETHYL ESTER
Formula: C36H42N4O4
Synonyms: Dimethyl 7,12-diethyl-3,8,13,17-tetramethyl-21H,23H-porphine-2,18-dipropionate;NSC 16668
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COMPUTED DESCRIPTORS

Molecular Weight 594.7 g/mol
XLogP3 5.3
Hydrogen Bond Donor Count 2
Hydrogen Bond Acceptor Count 6
Rotatable Bond Count 10
Exact Mass 594.32060583 g/mol
Monoisotopic Mass 594.32060583 g/mol
Topological Polar Surface Area 110 Ų
Heavy Atom Count 44
Formal Charge 0
Complexity 980
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