1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-

Base Information

• Chemical Name: 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-
• CAS No.: 58322-97-7
• Molecular Formula: C20H26 N2 O3
• Molecular Weight: 342.432
• DSSTox Substance ID: DTXSID40973860
• Wikidata: Q76151115

Synonyms:58322-97-7;1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-;DTXSID40973860;LS-137056;N-(8,9b-Dimethyl-3-oxo-1,2,3,4,4a,9b-hexahydrodibenzo[b,d]furan-4-yl)-2-(pyrrolidin-1-yl)ethanimidic acid

Chemical Property of 1-Pyrrolidineacetamide, N-(1,2,3,4,4a,9b-hexahydro-8,9b-dimethyl-3-oxo-4-dibenzofuranyl)-, (4-alpha,4a-beta,9b-beta)-

Chemical Property:

• Vapor Pressure: 4.93E-12mmHg at 25°C
• Boiling Point: 547.3°C at 760 mmHg
• Flash Point: 284.8°C
• Density: 1.23g/cm³
• XLogP3: 2.5
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 4
• Rotatable Bond Count: 3
• Exact Mass: 342.19434270
• Heavy Atom Count: 25
• Complexity: 545

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: CC1=CC2=C(C=C1)OC3C2(CCC(=O)C3NC(=O)CN4CCCC4)C
• Isomeric SMILES: CC1=CC2=C(C=C1)O[C@H]3[C@@]2(CCC(=O)[C@H]3NC(=O)CN4CCCC4)C

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