Products 853400-67-6

CAS 853400-67-6 appears in our catalog under these names: Fluo-3 (potassium salt), Fluo–3 (potassium salt), Pentapotassium, 2-(2-(2-(2-(bis(carboxylatomethyl)amino)-5-(2,7-dichloro-3-oxido-6-oxoxanthen-9-yl)phenoxy)ethoxy)-N-(carboxylatomet hyl)-4-methylanilino)acetate, Fluo-3 (pentapotassium). Offered by: TargetMol, GLPBio, Biosynth, MedChemExpress. Available pack sizes: 1mg, 5mg, 10mg, 25mg, Get quote.

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

Pentapotassium;2-[2-[2-[2-[bis(carboxylatomethyl)amino]-5-(2,7-dichloro-3-oxido-6-oxoxanthen-9-yl)phenoxy]ethoxy]-N-(carboxylatomethyl)-4-methylanilino]acetate (CAS 853400-67-6) is a chemical compound with the molecular formula C36H25Cl2K5N2O13 and a molecular weight of 960.0 g/mol. IUPAC name: pentapotassium;2-[2-[2-[2-[bis(carboxylatomethyl)amino]-5-(2,7-dichloro-3-oxido-6-oxoxanthen-9-yl)phenoxy]ethoxy]-N-(carboxylatomethyl)-4-methylanilino]acetate. InChIKey: HESJPJDGZLKNAU-UHFFFAOYSA-I.

Identity
Molecular formulaC36H25Cl2K5N2O13
Molecular weight960.0 g/mol
IUPAC namepentapotassium;2-[2-[2-[2-[bis(carboxylatomethyl)amino]-5-(2,7-dichloro-3-oxido-6-oxoxanthen-9-yl)phenoxy]ethoxy]-N-(carboxylatomethyl)-4-methylanilino]acetate
InChIKeyHESJPJDGZLKNAU-UHFFFAOYSA-I
SMILESCC1=CC(=C(C=C1)N(CC(=O)[O-])CC(=O)[O-])OCCOC2=C(C=CC(=C2)C3=C4C=C(C(=O)C=C4OC5=CC(=C(C=C53)Cl)[O-])Cl)N(CC(=O)[O-])CC(=O)[O-].[K+].[K+].[K+].[K+].[K+]

Computed by PubChem (NCBI)