CAS 4080-31-3 appears in our catalog under these names: Clethodim Impurity 21 Chloride (Mixture of Z and E Isomers), 1-(3-Chloroallyl)-1,3,5,7-tetraazaadamantan-1-ium Chloride, >95% (HPLC). Offered by: Chemat Brand, TRC. Available pack sizes: on request, 100mg, 1g, 250mg.
1-(3-chloroprop-2-enyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane chloride (CAS 4080-31-3) is a chemical compound with the molecular formula C9H16Cl2N4 and a molecular weight of 251.15 g/mol. IUPAC name: 1-(3-chloroprop-2-enyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane chloride. InChIKey: UKHVLWKBNNSRRR-UHFFFAOYSA-M.
| Molecular formula | C9H16Cl2N4 |
|---|---|
| Molecular weight | 251.15 g/mol |
| IUPAC name | 1-(3-chloroprop-2-enyl)-3,5,7-triaza-1-azoniatricyclo[3.3.1.13,7]decane chloride |
| InChIKey | UKHVLWKBNNSRRR-UHFFFAOYSA-M |
| SMILES | C1N2CN3CN1C[N+](C2)(C3)CC=CCl.[Cl-] |
Computed by PubChem (NCBI)