4-nitro-N,N-dipropylbenzamide
4-nitro-N,N-dipropylbenzamide
Also Known As: 4-nitro-N,N-dipropylbenzamide|4-nitro-N,N-dipropyl-benzamide|Oprea1_674718|p-nitrobenzoic acid dipropylamide|4-Nitro-N,N-di-n-propylbenzamide|Benzamide, p-nitro-N,N-dipropyl-
CAS: 79868-22-7
| Molecular Formula | C13H18N2O3 |
|---|---|
| Molecular Weight | 250.13174 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 66.1 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 250.13174 |
| Monoisotopic Mass | 250.13174 |
| Heavy Atoms | 18 |
| Complexity | 274.0 |
Chemical Identifiers
| CAS Number | 79868-22-7 |
|---|---|
| SMILES | CCCN(CCC)C(=O)C1=CC=C(C=C1)[N+](=O)[O-] |
| InChIKey | QMXJBGRHVJEDCV-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Pharmaceutical Intermediates (2 patents)
Product Overview
4-nitro-N,N-dipropylbenzamide (CAS 79868-22-7), with molecular formula C13H18N2O3 and molecular weight 250.13174 g/mol. IUPAC: 4-nitro-N,N-dipropylbenzamide.
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.
View MSDS →
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