BENZOYLECGONINE ISOPROPYL ESTER
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BENZOYLECGONINE ISOPROPYL ESTER
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CAS No:
137819-55-7
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Formula:
C19H25NO4
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Chemical Name:
BENZOYLECGONINE ISOPROPYL ESTER
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Synonyms:
benzoylecgonine isopropyl ester;CHEMBL338995;CTK6B0471;3-Benzoyloxy-8-methyl-8-aza-bicyclo[3.2.1]octane-2-carboxylic acid isopropyl ester;BDBM50035781;FT-0662598;Isopropyl 3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate;Isopropyl 3-(benzoyloxy)-8-methyl-8-azabicyclo[3.2.1]octane-2-carboxylate #
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CAS No:
BENZOYLECGONINE ISOPROPYL ESTER Use and Manufacturing
A 2β-substituted analog of cocaine as potential cocaine antagonist.Controlled substance.
Computed Properties
Molecular Weight:331.4
XLogP3:3.1
Hydrogen Bond Acceptor Count:5
Rotatable Bond Count:6
Exact Mass:331.17835828
Monoisotopic Mass:331.17835828
Topological Polar Surface Area:55.8
Heavy Atom Count:24
Complexity:472
Defined Atom Stereocenter Count:4
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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