| CAS Number | 1803582-50-4 |
| Catalog Number | AG01A8M4 |
| Chemical Name | 2-(decylsulfanyl)-4,5-dihydro-1H-imidazole hydrobromide |
| IUPAC Name | 2-decylsulfanyl-4,5-dihydro-1H-imidazole;hydrobromide |
| InChI | InChI=1S/C13H26N2S.BrH/c1-2-3-4-5-6-7-8-9-12-16-13-14-10-11-15-13;/h2-12H2,1H3,(H,14,15);1H |
| InChI Key | OZSAQBJPFPYPLR-UHFFFAOYSA-N |
| MDL Number | MFCD28125304 |
| Molecular Formula | C13H27BrN2S |
| Molecular Weight | 323.3359 |
| SMILES | Br.CCCCCCCCCCSC1NCCN=1 |
| Synonyms | 2-(decylsulfanyl)-4,5-dihydro-1H-imidazole hydrobromide,
1803582-50-4,
|
| Complexity | 192 |
| Compound Is Canonicalized | Yes |
| Covalently-Bonded Unit Count | 2 |
| Defined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Exact Mass | 322.108g/mol |
| Formal Charge | 0 |
| Heavy Atom Count | 17 |
| Hydrogen Bond Acceptor Count | 2 |
| Hydrogen Bond Donor Count | 2 |
| Isotope Atom Count | 0 |
| Molecular Weight | 323.337g/mol |
| Monoisotopic Mass | 322.108g/mol |
| Rotatable Bond Count | 10 |
| Topological Polar Surface Area | 49.7A^2 |
| Undefined Atom Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
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