N,N,N,2,2-pentamethyl-3-[(5-methyl-1-benzofuran-2-carbonyl)oxy]propan-1-aminium--iodide (1/1)
Chemical Structure Depiction of
N,N,N,2,2-pentamethyl-3-[(5-methyl-1-benzofuran-2-carbonyl)oxy]propan-1-aminium--iodide (1/1)
N,N,N,2,2-pentamethyl-3-[(5-methyl-1-benzofuran-2-carbonyl)oxy]propan-1-aminium--iodide (1/1)
Compound characteristics
| Compound ID: | 4646-0412 |
| Compound Name: | N,N,N,2,2-pentamethyl-3-[(5-methyl-1-benzofuran-2-carbonyl)oxy]propan-1-aminium--iodide (1/1) |
| Molecular Weight: | 431.31 |
| Molecular Formula: | C18 H26 N O3 |
| Salt: | I- |
| Smiles: | Cc1ccc2c(c1)cc(C(=O)OCC(C)(C)C[N+](C)(C)C)o2 |
| Stereo: | ACHIRAL |
| logP: | 3.7568 |
| logD: | 3.7568 |
| logSw: | -3.9054 |
| Hydrogen bond acceptors count: | 4 |
| Polar surface area: | 29.2497 |
| InChI Key: | FTUVEGJFKBYQKW-UHFFFAOYSA-N |