1-alpha-H,5-alpha-H-Tropanium, 8-(p-ethylbenzyl)-3-hydroxy-, bromide,xanthene-9-carboxylate(ester)
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1-alpha-H,5-alpha-H-Tropanium, 8-(p-ethylbenzyl)-3-hydroxy-, bromide,xanthene-9-carboxylate(ester)
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CAS No:
78371-77-4
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Formula:
C31H34NO3.Br
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Chemical Name:
1-alpha-H,5-alpha-H-Tropanium, 8-(p-ethylbenzyl)-3-hydroxy-, bromide,xanthene-9-carboxylate(ester)
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Synonyms:
8-(p-Ethylbenzyl)tropinium bromide xanthene-9-carboxylate;N-864;Tropinium, 8-(p-ethylbenzyl)-, bromide, xanthene-9-carboxylate;1-alpha-H,5-alpha-H-Tropanium, 8-(p-ethylbenzyl)-3-hydroxy-, bromide, xanthene-9-carboxylate(ester);DTXSID60999704;LS-157849;8-[(4-Ethylphenyl)methyl]-8-methyl-3-[(9H-xanthene-9-carbonyl)oxy]-8-azabicyclo[3.2.1]octan-8-ium bromide
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CAS No:
1-alpha-H,5-alpha-H-Tropanium, 8-(p-ethylbenzyl)-3-hydroxy-, bromide,xanthene-9-carboxylate(ester) Basic Attributes
548.518
547.17221
Computed Properties
Molecular Weight:548.5
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:6
Exact Mass:547.17221
Monoisotopic Mass:547.17221
Topological Polar Surface Area:35.5
Heavy Atom Count:36
Complexity:710
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:2
Compound Is Canonicalized:Yes
1-alpha-H,5-alpha-H-Tropanium, 8-(p-ethylbenzyl)-3-hydroxy-, bromide,xanthene-9-carboxylate(ester)
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