Account 1-Ethyl-2-(7-(1-ethyl-3,3-dimethyl-5-sulfoindolin-2-ylidene)hepta-1,3,5-trien-1-yl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate
- Catalog No. :
- ACWGTD946
- CAS No. :
- 186522-21-4
- Molecular Formula :
- C31H36N2O6S2
- Molecular Weight :
- 596.77
IUPAC Name:1-ethyl-2-((1E,3E,5E)-7-((Z)-1-ethyl-3,3-dimethyl-5-sulfoindolin-2-ylidene)hepta-1,3,5-trien-1-yl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate
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Product Information
| Product Name | 1-Ethyl-2-(7-(1-ethyl-3,3-dimethyl-5-sulfoindolin-2-ylidene)hepta-1,3,5-trien-1-yl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate |
|---|---|
| IUPAC Name | 1-ethyl-2-((1E,3E,5E)-7-((Z)-1-ethyl-3,3-dimethyl-5-sulfoindolin-2-ylidene)hepta-1,3,5-trien-1-yl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate |
| MDL No. | MFCD30470681 |
| Molecular Formula | C31H36N2O6S2 |
| Molecular Weight | 596.77 |
| SMILES | O=S(C1=CC2=C([N+](CC)=C(/C=C/C=C/C=C/C=C3N(CC)C4=C(C=C(S(=O)(O)=O)C=C4)C\3(C)C)C2(C)C)C=C1)([O-])=O |
| InChI Key | PNMKUVPOXYILJD-UHFFFAOYSA-N |
| Synonym | Cy7 (DiSO3, Di Et);Cy7 (DiSO3, Di Et) sulfo Cy7(Et)2;1-Ethyl-2-(7-(1-ethyl-3，3-dimethyl-5-sulfoindolin-2-ylidene)hepta-1，3，5-trien-1-yl)-3，3-dimethyl-3H-indol-1-ium-5-sulfonate |
| CAS No. | 186522-21-4 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319
- Precautionary Statement(s)
- P264-P270-P280-P301+P312+P330-P302+P352-P305+P351+P338-P332+P313-P337+P313-P362+P364-P501
Synthetic Route by SureRoute
2. ACWGTD946 Molecular Building Block Synthetic Route
1-Ethyl-2-(5-(1-ethyl-3,3-dimethyl-5-sulfoindolin-2-ylidene)penta-1,3-dien-1-yl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate
1-Ethyl-2-((3-(1-ethyl-3,3-dimethyl-5-sulfoindolin-2-ylidene)prop-1-en-1-yl)-3,3-dimethyl-3H-indol-1-ium-5-sulfonate
2-(5-(1-(5-Carboxypentyl)-3,3-dimethyl-5-sulfoindolin-2-ylidene)penta-1,3-dien-1-yl)-1-ethyl-3,3-dimethyl-3H-indol-1-ium-5-sulfonate