5-ethoxy-5-oxo-4-pyren-1-ylpentanoic acid
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5-ethoxy-5-oxo-4-pyren-1-ylpentanoic acid
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CAS No:
86803-14-7
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Formula:
C23H20O4
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Chemical Name:
5-ethoxy-5-oxo-4-pyren-1-ylpentanoic acid
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Synonyms:
86803-14-7;Pentanedioic acid, 2-(1-pyrenyl)-, 1-ethyl ester;DTXSID001007091;5-ethoxy-5-oxo-4-(pyren-1-yl)pentanoic acid
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CAS No:
Computed Properties
Molecular Weight:360.4
XLogP3:5.1
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:7
Exact Mass:360.13615911
Monoisotopic Mass:360.13615911
Topological Polar Surface Area:63.6
Heavy Atom Count:27
Complexity:559
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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