Aposcopolamine
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Aposcopolamine
structure -
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CAS No:
535-26-2
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Formula:
C17H19NO3
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Chemical Name:
Aposcopolamine
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Synonyms:
Benzeneacetic acid,α-methylene-,(1α,2β,4β,5α,7β)-9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester;Aposcopolamine;1αH,5αH-Tropan-3α-ol,6β,7β-epoxy-,atropate (ester);Benzeneacetic acid,α-methylene-,9-methyl-3-oxa-9-azatricyclo[3.3.1.02,4]non-7-yl ester,(1α,2β,4β,5α,7β)-;3-Oxa-9-azatricyclo[3.3.1.02,4]nonane,benzeneacetic acid deriv.;Apohyoscine;Aposcopolamin;34260-99-6;862901-23-3;1065500-46-0
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CAS No:
Characteristics
42.07000
1.79330
1.25g/cm3
97 °C @ Solvent: Diethyl ether
415.5ºC at 760mmHg
205.1ºC
1.604
-20°C Freezer
Computed Properties
Molecular Weight:285.34
XLogP3:2.6
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:4
Exact Mass:285.13649347
Monoisotopic Mass:285.13649347
Topological Polar Surface Area:42.1
Heavy Atom Count:21
Complexity:439
Defined Atom Stereocenter Count:2
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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