Products 757960-10-4

CAS 757960-10-4 appears in our catalog under these names: IR-806, S 0378 - FEW Chemicals, 806 nm in MeOH, 1 g, glass, S 0378 - FEW Chemicals, 806 nm in MeOH, 5 g, plastic, S 0378 - FEW Chemicals, 806 nm in MeOH, 10 g, plastic, Sodium 4-(2-(2-(2-chloro-3-(2-(3,3-dimethyl-1-(4-sulfonatobutyl)-3H-indol-1-ium-2-yl)vinyl)cyclopent-2-en-1-ylidene)ethylidene)-3,3-dimethylindolin-1-yl)butane-1-sulfonate. Offered by: Biosynth, Roth, Chemat. Available pack sizes: 2g, 5g, 1g, 10g, 50mg, 250mg.

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

Sodium 4-[(2Z)-2-[(2Z)-2-[2-chloro-3-[(E)-2-[3,3-dimethyl-1-(4-sulfonatobutyl)indol-1-ium-2-yl]ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butane-1-sulfonate (CAS 757960-10-4) is a chemical compound with the molecular formula C37H44ClN2NaO6S2 and a molecular weight of 735.3 g/mol. IUPAC name: sodium 4-[(2Z)-2-[(2Z)-2-[2-chloro-3-[(E)-2-[3,3-dimethyl-1-(4-sulfonatobutyl)indol-1-ium-2-yl]ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butane-1-sulfonate. InChIKey: MIOUAELAUIYKFC-UHFFFAOYSA-M.

Identity
Molecular formulaC37H44ClN2NaO6S2
Molecular weight735.3 g/mol
IUPAC namesodium 4-[(2Z)-2-[(2Z)-2-[2-chloro-3-[(E)-2-[3,3-dimethyl-1-(4-sulfonatobutyl)indol-1-ium-2-yl]ethenyl]cyclopent-2-en-1-ylidene]ethylidene]-3,3-dimethylindol-1-yl]butane-1-sulfonate
InChIKeyMIOUAELAUIYKFC-UHFFFAOYSA-M
SMILESCC1(C2=CC=CC=C2[N+](=C1/C=C/C3=C(/C(=C\C=C/4\C(C5=CC=CC=C5N4CCCCS(=O)(=O)[O-])(C)C)/CC3)Cl)CCCCS(=O)(=O)[O-])C.[Na+]

Computed by PubChem (NCBI)