Account 2-(3,6-Bis(dimethylamino)xanthylium-9-yl)-5-isothiocyanatobenzoate
- Catalog No. :
- ACNIVU202
- CAS No. :
- 80724-19-2
- Molecular Formula :
- C25H21N3O3S
- Molecular Weight :
- 443.53
IUPAC Name:2-(6-(dimethylamino)-3-(dimethyliminio)-3H-xanthen-9-yl)-5-isothiocyanatobenzoate
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Product Information
| Product Name | 2-(3,6-Bis(dimethylamino)xanthylium-9-yl)-5-isothiocyanatobenzoate |
|---|---|
| IUPAC Name | 2-(6-(dimethylamino)-3-(dimethyliminio)-3H-xanthen-9-yl)-5-isothiocyanatobenzoate |
| MDL No. | MFCD00467978 |
| Molecular Formula | C25H21N3O3S |
| Molecular Weight | 443.53 |
| SMILES | CN(C1=CC2=[O+]C3=C(C=CC(N(C)C)=C3)C(C4=CC=C(N=C=S)C=C4C([O-])=O)=C2C=C1)C |
| InChI Key | IJSMFQNTEUNRPY-UHFFFAOYSA-N |
| Synonym | tetramethylrhodamine-5-isothiocyanate(5-tritc;5-TRITC, G isomer;TETRAMETHYLRHODAMINE-5-ISOTHIOCYANATE, G-ISOMER;Gisomer;5-TRITC, Xanthylium;9-(2-Carboxy-4-isothiocyanatophenyl)-3,6-bis(dimethylamino)xanthylium inner salt;G isoMer [TetraMethylrhodaMine-5-isothiocyanate];5-TRITC [Tetramethylrhodamine-5-isothiocyanate] *CAS 80724-19-2* |
| CAS No. | 80724-19-2 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H315-H317-H319-H330-H334-H335-H351-H412
- Precautionary Statement(s)
- P201-P202-P260-P264-P271-P272-P273-P280-P284-P302+P352-P304+P340+P310-P305+P351+P338-P308+P313-P333+P313-P337+P313-P403+P233-P405-P501
Synthetic Route by SureRoute
2. ACNIVU202 Molecular Building Block Synthetic Route
Rhodamine B, tetramethyl-, isothiocyanate
N-(9-(2-carboxy-4-isothiocyanatophenyl)-6-(diethylamino)-3H-xanthen-3-ylidene)-N-ethylethanaminium chloride
9-(2-Carboxy-4-isothiocyanatophenyl)-3,6-bis(diethylamino)xanthylium chloride