N,N-diethyl-N-[3-(3-methylphenyl)prop-2-yn-1-yl]prop-2-en-1-aminium--bromide (1/1)
Chemical Structure Depiction of
N,N-diethyl-N-[3-(3-methylphenyl)prop-2-yn-1-yl]prop-2-en-1-aminium--bromide (1/1)
N,N-diethyl-N-[3-(3-methylphenyl)prop-2-yn-1-yl]prop-2-en-1-aminium--bromide (1/1)
Compound characteristics
| Compound ID: | 4636-0074 |
| Compound Name: | N,N-diethyl-N-[3-(3-methylphenyl)prop-2-yn-1-yl]prop-2-en-1-aminium--bromide (1/1) |
| Molecular Weight: | 322.29 |
| Molecular Formula: | C17 H24 N |
| Salt: | Br- |
| Smiles: | CC[N+](CC)(CC=C)CC#Cc1cccc(C)c1 |
| Stereo: | ACHIRAL |
| logP: | 4.2786 |
| logD: | 4.2786 |
| logSw: | -4.3391 |
| Polar surface area: | 0.4534 |
| InChI Key: | AQOFTLQNGNTNGS-UHFFFAOYSA-N |