Products 53213-86-8

CAS 53213-86-8 appears in our catalog under these names: 3,3'-Di-n-pentylthiacarbocyanine iodide, 95%, 3,3'-Di-n-pentylthiacarbocyanine iodide, 90%, 90%. Offered by: Combi-blocks, Chemat. Available pack sizes: 250mg, 1g.

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

3-pentyl-2-[3-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzothiazole iodide (CAS 53213-86-8) is a chemical compound with the molecular formula C27H33IN2S2 and a molecular weight of 576.6 g/mol. IUPAC name: 3-pentyl-2-[3-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzothiazole iodide. InChIKey: XKLVNGIUXSOJRR-UHFFFAOYSA-M.

Identity
Molecular formulaC27H33IN2S2
Molecular weight576.6 g/mol
IUPAC name3-pentyl-2-[3-(3-pentyl-1,3-benzothiazol-3-ium-2-yl)prop-2-enylidene]-1,3-benzothiazole iodide
InChIKeyXKLVNGIUXSOJRR-UHFFFAOYSA-M
SMILESCCCCCN1C2=CC=CC=C2SC1=CC=CC3=[N+](C4=CC=CC=C4S3)CCCCC.[I-]

Computed by PubChem (NCBI)