8a-(4-Methylphenyl)-3,4,8,8a-tetrahydro-2H-pyrrolo[2,1-b][1,3]oxazin-6(7H)-one
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![8a-(4-Methylphenyl)-3,4,8,8a-tetrahydro-2H-pyrrolo[2,1-b][1,3]oxazin-6(7H)-one structure](https://file.echemi.com/fileManage/upload/canonicalSmiles/20220811/611e6618ce5c46af926e2e3153d8fa09.png "8a-(4-Methylphenyl)-3,4,8,8a-tetrahydro-2H-pyrrolo[2,1-b][1,3]oxazin-6(7H)-one")
8a-(4-Methylphenyl)-3,4,8,8a-tetrahydro-2H-pyrrolo[2,1-b][1,3]oxazin-6(7H)-one
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CAS No:
7088-17-7
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Formula:
C14H17NO2
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Chemical Name:
8a-(4-Methylphenyl)-3,4,8,8a-tetrahydro-2H-pyrrolo[2,1-b][1,3]oxazin-6(7H)-one
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Synonyms:
BRN 1218004;2H-Pyrrolo(2,1-b)(1,3)oxazin-6-one, 3,4,6,7,8,8a-hexahydro-8a-(p-tolyl)-;8a-(p-Tolyl)-3,4,6,7,8,8a-hexahydro-2H-pyrrolo(2,1-b)(1,3)oxazin-6-one;CHEMBL3275892;DTXSID00991161;AKOS002669552;LS-139444;8a-(4-Methylphenyl)tetrahydro-2H-pyrrolo[2,1-b][1,3]oxazin-6(7H)-one;8a-(4-Methylphenyl)-3,4,8,8a-tetrahydro-2H-pyrrolo[2,1-b][1,3]oxazin-6(7H)-one
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CAS No:
8a-(4-Methylphenyl)-3,4,8,8a-tetrahydro-2H-pyrrolo[2,1-b][1,3]oxazin-6(7H)-one Basic Attributes
231.295
231.126
Characteristics
29.5
1.6
1.19±0.1 g/cm3(Predicted)
35 °C(Solv: ethyl ether (60-29-7))
LD50 intraperitoneal in rat: 675mg/kg
Computed Properties
Molecular Weight:231.29
XLogP3:1.6
Hydrogen Bond Acceptor Count:2
Rotatable Bond Count:1
Exact Mass:231.125928785
Monoisotopic Mass:231.125928785
Topological Polar Surface Area:29.5
Heavy Atom Count:17
Complexity:309
Undefined Atom Stereocenter Count:1
Covalently-Bonded Unit Count:1
Compound Is Canonicalized:Yes
8a-(4-Methylphenyl)-3,4,8,8a-tetrahydro-2H-pyrrolo[2,1-b][1,3]oxazin-6(7H)-one
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