(+)-Isothebaine
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(+)-Isothebaine
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CAS No:
568-21-8
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Formula:
C19H21NO3
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Chemical Name:
(+)-Isothebaine
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Synonyms:
4H-Dibenzo[de,g]quinolin-1-ol,5,6,6a,7-tetrahydro-2,11-dimethoxy-6-methyl-,(6aS)-;6aα-Aporphin-1-ol,2,11-dimethoxy-;Isothebaine;4H-Dibenzo[de,g]quinolin-1-ol,5,6,6a,7-tetrahydro-2,11-dimethoxy-6-methyl-,(S)-;(6aS)-5,6,6a,7-Tetrahydro-2,11-dimethoxy-6-methyl-4H-dibenzo[de,g]quinolin-1-ol;(+)-Isothebaine;1-Hydroxy-2,11-dimethoxy-6aα-aporphine;2,11-Dimethoxy-6aα-aporphin-1-ol;NSC 290957;21925-67-7
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CAS No:
Characteristics
41.9
3.09940
1.219g/cm3
203-204 °C
489.2ºC at 760mmHg
249.6ºC
1.617
D18 +285° in alc
Computed Properties
Molecular Weight:311.4
XLogP3:2.6
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:4
Rotatable Bond Count:2
Exact Mass:311.15214353
Monoisotopic Mass:311.15214353
Topological Polar Surface Area:41.9
Heavy Atom Count:23
Complexity:431
Defined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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