Products 3079716-72-3

CAS 3079716-72-3 is the registry number for Q1-SM-102 (iodide). Offered by: MedChemExpress. Available pack sizes: Get quote.

Structural formula: {0} (CAS {1})

(8-heptadecan-9-yloxy-8-oxooctyl)-(2-hydroxyethyl)-methyl-(6-oxo-6-undecoxyhexyl)azanium iodide (CAS 3079716-72-3) is a chemical compound with the molecular formula C45H90INO5 and a molecular weight of 852.1 g/mol. IUPAC name: (8-heptadecan-9-yloxy-8-oxooctyl)-(2-hydroxyethyl)-methyl-(6-oxo-6-undecoxyhexyl)azanium iodide. InChIKey: OFVAGWVUQMTSAD-UHFFFAOYSA-M.

Identity
Molecular formulaC45H90INO5
Molecular weight852.1 g/mol
IUPAC name(8-heptadecan-9-yloxy-8-oxooctyl)-(2-hydroxyethyl)-methyl-(6-oxo-6-undecoxyhexyl)azanium iodide
InChIKeyOFVAGWVUQMTSAD-UHFFFAOYSA-M
SMILESCCCCCCCCCCCOC(=O)CCCCC[N+](C)(CCCCCCCC(=O)OC(CCCCCCCC)CCCCCCCC)CCO.[I-]

Computed by PubChem (NCBI)