Products 162411-29-2

CAS 162411-29-2 appears in our catalog under these names: 2-(2-(2-Chloro-3-(2-(3-ethyl-1,1-dimethyl-1,3-dihydro-2H-benzo[e]indol-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-3-ethyl-1,1-dimethyl-1H-benzo[e]indol-3-ium iodide, 99%, 99%, Heptamethine cyanine dye-1, Heptamethine cyanine dye-1, 96.0%. Offered by: Chemat, Biosynth, MedChemExpress. Available pack sizes: 25mg, 50mg, 100mg, 250mg, 10mg, 25 mg, 100 mg, 10mM/1mL.

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

(2E)-2-[(2E)-2-[2-chloro-3-[(E)-2-(3-ethyl-1,1-dimethylbenzo[e]indol-3-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-3-ethyl-1,1-dimethylbenzo[e]indole iodide (CAS 162411-29-2) is a chemical compound with the molecular formula C42H44ClIN2 and a molecular weight of 739.2 g/mol. IUPAC name: (2E)-2-[(2E)-2-[2-chloro-3-[(E)-2-(3-ethyl-1,1-dimethylbenzo[e]indol-3-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-3-ethyl-1,1-dimethylbenzo[e]indole iodide. InChIKey: CNQCCCLLXKARPK-UHFFFAOYSA-M.

Identity
Molecular formulaC42H44ClIN2
Molecular weight739.2 g/mol
IUPAC name(2E)-2-[(2E)-2-[2-chloro-3-[(E)-2-(3-ethyl-1,1-dimethylbenzo[e]indol-3-ium-2-yl)ethenyl]cyclohex-2-en-1-ylidene]ethylidene]-3-ethyl-1,1-dimethylbenzo[e]indole iodide
InChIKeyCNQCCCLLXKARPK-UHFFFAOYSA-M
SMILESCCN\1C2=C(C3=CC=CC=C3C=C2)C(/C1=C\C=C\4/CCCC(=C4Cl)/C=C/C5=[N+](C6=C(C5(C)C)C7=CC=CC=C7C=C6)CC)(C)C.[I-]

Computed by PubChem (NCBI)