1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one
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![1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/37741d43c81e48e98a67e0512d57acdd.png "1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one")
1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one
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CAS No:
99614-14-9
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Formula:
C17H17N3O
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Chemical Name:
1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one
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Synonyms:
4H-Carbazol-4-one,1,2,3,9-tetrahydro-3-[(2-methyl-1H-imidazol-1-yl)methyl]-;1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one;N-desmethylondansetron;Desmethylondansetron;1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazole-1-yl)methyl]-4H-carbazol-4-one;3-[(2-Methylimidazol-1-yl)methyl]-1,2,3,9-tetrahydrocarbazol-4-one
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CAS No:
1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one Basic Attributes
279.34
279.34
2933990090
Characteristics
50.68000
3.11810
1.33±0.1 g/cm3
234-236°C
550.4±30.0 °C(Predicted)
286.7ºC
1.707
15.70±0.40
1,2,3,9-Tetrahydro-3-[(2-methyl-1H-imidazol-1-yl)methyl]-4H-carbazol-4-one Use and Manufacturing
A metabolite of Ondansetron
Computed Properties
Molecular Weight:279.34
XLogP3:2.3
Hydrogen Bond Donor Count:1
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:2
Exact Mass:279.137162174
Monoisotopic Mass:279.137162174
Topological Polar Surface Area:50.7
Heavy Atom Count:21
Complexity:413
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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