9-(2-Carboxy-4-Isothiocyanatophenyl)-6-(Dimethylamino)-N,N-Dimethyl-3H-Xanthen-3-Iminium Chloride
[CAS# 6749-36-6]

Identification

• Name: 9-(2-Carboxy-4-Isothiocyanatophenyl)-6-(Dimethylamino)-N,N-Dimethyl-3H-Xanthen-3-Iminium Chloride
• Synonyms: 9-(2-carboxy-4-isothiocyanatophenyl)-3,6-bis(dimethylamino)xanthylium chloride; R-Tetramethylrhodamine isothiocyanate
• Molecular Formula: C₂₅H₂₂ClN₃O₃S
• Molecular Weight: 479.98
• CAS Registry Number: 6749-36-6
• EINECS: 229-808-3
• SMILES: [Cl-].S=C=N/c4ccc(C=1c3c(OC=2C=1\C=C/C(=[N+](/C)C)/C=2)cc(cc3)N(C)C)c(C(=O)O)c4
• InChI: 1S/C25H21N3O3S.ClH/c1-27(2)16-6-9-19-22(12-16)31-23-13-17(28(3)4)7-10-20(23)24(19)18-8-5-15(26-14-32)11-21(18)25(29)30;/h5-13H,1-4H3;1H
• InChIKey: ZIDZWKOOWSJOJR-UHFFFAOYSA-N