N-[3-(butyrylamino)phenyl]-1,3-benzodioxole-5-carboxamide
N-[3-(butanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide
Also Known As: BAS 08883676|N-[3-(butyrylamino)phenyl]-1,3-benzodioxole-5-carboxamide|N-[3-(butanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide|AP-970/42736701|Benzo[1,3]dioxole-5-carboxylic acid (3-butyrylamino-phenyl)-amide|N-[3-(2H-benzo[3,4-d]1,3-dioxolan-5-ylcarbonylamino)phenyl]butanamide
CAS: 797779-65-8
| Molecular Formula | C18H18N2O4 |
|---|---|
| Molecular Weight | 326.12665 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 76.7 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 326.12665 |
| Monoisotopic Mass | 326.12665 |
| Heavy Atoms | 24 |
| Complexity | 456.0 |
Chemical Identifiers
| CAS Number | 797779-65-8 |
|---|---|
| SMILES | CCCC(=O)NC1=CC(=CC=C1)NC(=O)C2=CC3=C(C=C2)OCO3 |
| InChIKey | WDNBILUKXNDUHE-UHFFFAOYSA-N |
Product Overview
N-[3-(butyrylamino)phenyl]-1,3-benzodioxole-5-carboxamide (CAS 797779-65-8), with molecular formula C18H18N2O4 and molecular weight 326.12665 g/mol. IUPAC: N-[3-(butanoylamino)phenyl]-1,3-benzodioxole-5-carboxamide.
Safety Data Sheet (MSDS / SDS)
View the Laboratory Chemical Safety Summary (LCSS) on PubChem — includes GHS classifications, hazard statements, first aid measures, and handling precautions.
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