3-(1,3-Benzodioxol-5-yl)propanamide

Base Information

• Chemical Name: 3-(1,3-Benzodioxol-5-yl)propanamide
• CAS No.: 20799-84-2
• Molecular Formula: C10H11NO3
• Molecular Weight: 193.202
• DSSTox Substance ID: DTXSID00565326
• Wikidata: Q82450370

Synonyms:3-(1,3-benzodioxol-5-yl)propanamide;20799-84-2;3-(2H-1,3-Benzodioxol-5-yl)propanamide;SCHEMBL300007;DTXSID00565326;WCEYZMWVZAQEPJ-UHFFFAOYSA-N;AKOS005231113;3-(3,4-methylenedioxyphenyl)propanamide

Chemical Property of 3-(1,3-Benzodioxol-5-yl)propanamide

Chemical Property:

• Melting Point: 122 °C
• Boiling Point: 416.3±24.0 °C(Predicted)
• PSA: 62.54000
• Density: 1.281±0.06 g/cm3(Predicted)
• LogP: 1.98290
• XLogP3: 1
• Hydrogen Bond Donor Count: 1
• Hydrogen Bond Acceptor Count: 3
• Rotatable Bond Count: 3
• Exact Mass: 193.07389321
• Heavy Atom Count: 14
• Complexity: 219

Purity/Quality:

Safty Information:

• Pictogram(s):  
• Hazard Codes: 

MSDS Files:

SDS file from LookChem

Useful:

• Canonical SMILES: C1OC2=C(O1)C=C(C=C2)CCC(=O)N

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