Tetramethylrhodamine-5-isothiocyanate

2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-5-isothiocyanatobenzoate

Also Known As: Tetramethylrhodamine-5-isothiocyanate|5-TRITC|Xanthylium|5-TRITC, G isomer|HY-D0153|TD0057|2-[3-(dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-5-isothiocyanatobenzoate|2-(3,6-Bis(dimethylamino)xanthylium-9-yl)-5-isothiocyanatobenzoate|J2.053.516D|5-TRITC; G isomer [Tetramethylrhodamine-5-isothiocyanate]|Benzenepropanoic acid, 3-methoxy-.beta.-oxo-, ethyl ester|2-(3-(Dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl)-5-isothiocyanatobenzoate|9-(2-Carboxy-4-isothiocyanatophenyl)-3,6-bis(dimethylamino)xanthylium inner salt|Xanthylium, 9-(2-carboxy-4-isothiocyanatophenyl)-3,6-bis(dimethylamino)-, inner salt|2-(3-dimethylamino-6-dimethylazaniumylidene-xanthen-9-yl)-5-isothiocyanato-benzoate|2-[3-(dimethylamino)-6-dimethyliminio-xanthen-9-yl]-5-isothiocyanato-benzoate|2-[6-(Dimethylamino)-3-(dimethyliminio)-3H-xanthen-9-yl]-5-isothiocyanatobenzoate|2-[6-(DIMETHYLAMINO)-3-(DIMETHYLIMINIUMYL)-3H-XANTHEN-9-YL]-5-ISOTHIOCYANATOBENZOATE|Dimethyl[6-(dimethylamino)-9-[2-carboxylato-4-(isothiocyanato)phenyl]-3H-xanthene-3-ylidene]aminium|Tetramethylrhodamine-5-isothiocyanate; Xanthylium, 9-(2-carboxy-4-isothiocyanatophenyl)-3,6-bis(dimethylamino)-, inner salt (9CI, ACI); 9-(2-Carboxy-4-isothiocyanatophenyl)-3,6-bis(dimethylamino)xanthylium inner salt (ACI); 2-[3-(Dimethylamino)-6-dimethylazaniumylidenexanthen-9-yl]-5-isothiocy

Molecular Formula	C25H21N3O3S
Molecular Weight	443.13037 g/mol
LogP	3.4002
Topological Polar Surface Area	71.88 Ų
Hydrogen Bond Donors	0
Hydrogen Bond Acceptors	6
Rotatable Bonds	4
Exact Mass	443.13037
Monoisotopic Mass	443.13037
Heavy Atoms	32
Complexity	1459.3525

Chemical Identifiers

CAS Number	80724-19-2
SMILES	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-]