Products 449175-57-9

CAS 449175-57-9 is the registry number for Cyanine 3 Monofunctional Hexanoic Acid Dye, Potassium Salt, 90.0%. Offered by: Chemat. Available pack sizes: 200mg, 1g.

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

Potassium 2-[3-[1-(5-carboxypentyl)-3,3-dimethyl-5-sulfonatoindol-1-ium-2-yl]prop-2-enylidene]-1-ethyl-3,3-dimethylindole-5-sulfonate (CAS 449175-57-9) is a chemical compound with the molecular formula C31H37KN2O8S2 and a molecular weight of 668.9 g/mol. IUPAC name: potassium 2-[3-[1-(5-carboxypentyl)-3,3-dimethyl-5-sulfonatoindol-1-ium-2-yl]prop-2-enylidene]-1-ethyl-3,3-dimethylindole-5-sulfonate. InChIKey: YISNCKBAILWZRU-UHFFFAOYSA-M.

Identity
Molecular formulaC31H37KN2O8S2
Molecular weight668.9 g/mol
IUPAC namepotassium 2-[3-[1-(5-carboxypentyl)-3,3-dimethyl-5-sulfonatoindol-1-ium-2-yl]prop-2-enylidene]-1-ethyl-3,3-dimethylindole-5-sulfonate
InChIKeyYISNCKBAILWZRU-UHFFFAOYSA-M
SMILESCCN1C2=C(C=C(C=C2)S(=O)(=O)[O-])C(C1=CC=CC3=[N+](C4=C(C3(C)C)C=C(C=C4)S(=O)(=O)[O-])CCCCCC(=O)O)(C)C.[K+]

Computed by PubChem (NCBI)