Products 80724-20-5

CAS 80724-20-5 appears in our catalog under these names: Tetramethylrhodamine Isothiocyanate Isomer R (Technical grade), 6-TRITC, 6-TRITC, 95.0%, 2-(3,6-Bis(dimethylamino)xanthylium-9-yl)-4-isothiocyanatobenzoate, 95%. Offered by: TRC, Chemat, MedChemExpress. Available pack sizes: 50mg, 100mg, 10mg, 1 mg, 5mg.

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

2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-4-isothiocyanatobenzoate (CAS 80724-20-5) is a chemical compound with the molecular formula C25H21N3O3S and a molecular weight of 443.5 g/mol. IUPAC name: 2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-4-isothiocyanatobenzoate. InChIKey: OBYNJKLOYWCXEP-UHFFFAOYSA-N.

Identity
Molecular formulaC25H21N3O3S
Molecular weight443.5 g/mol
IUPAC name2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-4-isothiocyanatobenzoate
InChIKeyOBYNJKLOYWCXEP-UHFFFAOYSA-N
SMILESCN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C=CC(=C4)N=C=S)C(=O)[O-]

Computed by PubChem (NCBI)