1-[3-(3-phenylpropyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one
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![1-[3-(3-phenylpropyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/48ff7c2b068144d8bba03478e0542b01.png "1-[3-(3-phenylpropyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one")
1-[3-(3-phenylpropyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one
structure -
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CAS No:
63990-14-7
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Formula:
C18H26N2O
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Chemical Name:
1-[3-(3-phenylpropyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one
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Synonyms:
63990-14-7;BRN 0537504;3-Phenethylmethyl-8-propionyl-3,8-diazabicyclo(3.2.1)octane;3,8-Diazabicyclo(3.2.1)octane, 3-(3'-(phenyl)propyl)-8-propionyl-;DTXSID60981740;1-[3-(3-phenylpropyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one;3-(3-Phenylpropyl)-8-propionyl-3,8-diazabicyclo[3.2.1]octane
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CAS No:
1-[3-(3-phenylpropyl)-3,8-diazabicyclo[3.2.1]octan-8-yl]propan-1-one Basic Attributes
286.4 g/mol
286.204513457 g/mol
Toxicity
| Name | Type of Test | Exposure Route | Species Observed | Dose/Duration | Toxic Effects | Reference |
|---|---|---|---|---|---|---|
| ACUTE TOXICITY DATA | LD50 - Lethal dose, 50 percent kill | Intraperitoneal | Rodent - mouse | 300 mg/kg | Details of toxic effects not reported other than lethal dose value-- | Research Progress in Organic-Biological and Medicinal Chemistry. (New York, NY) V.1-3, 1964-72. Discontinued. Volume(issue)/page/year: 2,195,1970 |
Computed Properties
Molecular Weight:286.4
XLogP3:2.9
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:5
Exact Mass:286.204513457
Monoisotopic Mass:286.204513457
Topological Polar Surface Area:23.6
Heavy Atom Count:21
Complexity:337
Undefined Atom Stereocenter Count:2
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
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