propanil | SBID = 2349 | Compound |
Structure
Molecular Properties
| Interactions: | 1 | ||
| PubChem TPSA/Å2: | 29.1 | ||
| Ertl TPSA/Å2: | 29.1 | ||
| Hydrophilicity (PubChem XLogP): | 3.1 | ||
| Hydrophilicity (Cheng XLogP3): | 3.07 | ||
| Charge: | 0.0 | ||
| Number of H-Bond Donors: | 1.0 | ||
| Number of H-Bond Acceptors: | 1.0 | ||
| Number of Stereogenic Bonds (E/Z): | 0.0 | ||
| Number of Stereogenic Atoms (R/S): | 0.0 | ||
| 3D Volume/Å3: | 157.0 | ||
| Sum Formula: | C9H9Cl2NO | ||
| M / g/mol: | 218.08 | ||
| Complexity: | 187.0 | ||
| Number of Conformers: | 6.0 |
Identifiers
- Tags: drug
- Name: propanil
- Preferred Abbreviation: propanil
- IUPAC Name: N-(3,4-dichlorophenyl)propanamide
- CAS:
- CID: 4933
- InChiKey: LFULEKSKNZEWOE-UHFFFAOYSA-N
- InChi: InChI=1S/C9H9Cl2NO/c1-2-9(13)12-6-3-4-7(10)8(11)5-6/h3-5H,2H2,1H3,(H,12,13)
- CanoSmiles: CCC(=O)NC1=CC(=C(C=C1)Cl)Cl
- IsoSmiles: CCC(=O)NC1=CC(=C(C=C1)Cl)Cl
