N-(2-ethoxy-2-oxoethyl)-N,N-diethyl-3-phenylprop-2-yn-1-aminium--bromide (1/1)
Chemical Structure Depiction of
N-(2-ethoxy-2-oxoethyl)-N,N-diethyl-3-phenylprop-2-yn-1-aminium--bromide (1/1)
N-(2-ethoxy-2-oxoethyl)-N,N-diethyl-3-phenylprop-2-yn-1-aminium--bromide (1/1)
Compound characteristics
| Compound ID: | 5504-0076 |
| Compound Name: | N-(2-ethoxy-2-oxoethyl)-N,N-diethyl-3-phenylprop-2-yn-1-aminium--bromide (1/1) |
| Molecular Weight: | 354.29 |
| Molecular Formula: | C17 H24 N O2 |
| Salt: | Br- |
| Smiles: | CC[N+](CC)(CC#Cc1ccccc1)CC(=O)OCC |
| Stereo: | ACHIRAL |
| logP: | 3.4612 |
| logD: | 3.4612 |
| logSw: | -3.3554 |
| Hydrogen bond acceptors count: | 3 |
| Polar surface area: | 20.6338 |
| InChI Key: | CETFZGNQKJNYGK-UHFFFAOYSA-N |