Products 339221-91-9

CAS 339221-91-9 appears in our catalog under these names: Ammonium 2,2'-((2-(2-(2-(bis(carboxylatomethyl)amino)-5-(2,7-dichloro-6-oxido-3-oxo-3H-xanthen-9-yl)phenoxy)ethoxy)-4-methylphenyl)azanediyl)diacetate, 97%, Fluo-3 (ammonium salt), Fluo–3 (ammonium salt), Fluo-3 (ammonium salt), ≥90%, ≥90%, Fluo-3 (pentaammonium). Offered by: Chemat Brand, TargetMol, GLPBio, Chemat, MedChemExpress. Available pack sizes: on request, 1mg, Get quote.

Pentaazanium;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 339221-91-9) is a chemical compound with the molecular formula C36H45Cl2N7O13 and a molecular weight of 854.7 g/mol. IUPAC name: pentaazanium;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: ABPVTPOQYAKASW-UHFFFAOYSA-N.

Identity
Molecular formulaC36H45Cl2N7O13
Molecular weight854.7 g/mol
IUPAC namepentaazanium;2-[2-[2-[2-[bis(carboxylatomethyl)amino]-5-(2,7-dichloro-3-oxido-6-oxoxanthen-9-yl)phenoxy]ethoxy]-N-(carboxylatomethyl)-4-methylanilino]acetate
InChIKeyABPVTPOQYAKASW-UHFFFAOYSA-N
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-].[NH4+].[NH4+].[NH4+].[NH4+].[NH4+]

Computed by PubChem (NCBI)