Products 95197-95-8

CAS 95197-95-8 appears in our catalog under these names: Tetramethylrhodamine isothiocyanate (mixed isomers), 5(6)-TRITC (Tetramethylrhodamine-5-(and-6)-isothiocyanate) *Mixed isomers*, 5(6)-Tetramethylrhodamine isot , Tetramethylrhodamine isothiocyanate - mixed isomers, Tetramethylrhodamine isothiocyanate, mixed isomers, 90.00%. Offered by: GLPBio, TargetMol, Thermo Scientific (Alfa Aesar), Biosynth, Chemat. Available pack sizes: 1mg, 10mg, 5mg, 25mg, 250mg, 50mg, 100mg, 10 mg.

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

2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-5-isothiocyanatobenzoate;2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-6-isothiocyanatobenzoate (CAS 95197-95-8) is a chemical compound with the molecular formula C50H42N6O6S2 and a molecular weight of 887.0 g/mol. IUPAC name: 2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-5-isothiocyanatobenzoate;2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-6-isothiocyanatobenzoate. InChIKey: DTICYSNQBDFZSM-UHFFFAOYSA-N.

Identity
Molecular formulaC50H42N6O6S2
Molecular weight887.0 g/mol
IUPAC name2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-5-isothiocyanatobenzoate;2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-6-isothiocyanatobenzoate
InChIKeyDTICYSNQBDFZSM-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-].CN(C)C1=CC2=C(C=C1)C(=C3C=CC(=[N+](C)C)C=C3O2)C4=C(C=C(C=C4)N=C=S)C(=O)[O-]

Computed by PubChem (NCBI)