Account 4-(2-((1E,3E,5E)-5-(1-(5-Carboxypentyl)-3,3-dimethylindolin-2-ylidene)penta-1,3-dien-1-yl)-3,3-dimethyl-3H-indol-1-ium-1-yl)butane-1-sulfonate
- Catalog No. :
- ACAHJZ527
- CAS No. :
- 644979-16-8
- Molecular Formula :
- C35H44N2O5S
- Molecular Weight :
- 604.81
IUPAC Name:4-((Z)-2-((2E,4E)-5-(1-(5-carboxypentyl)-3,3-dimethyl-3H-indol-1-ium-2-yl)penta-2,4-dien-1-ylidene)-3,3-dimethylindolin-1-yl)butane-1-sulfonate
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Product Information
| Product Name | 4-(2-((1E,3E,5E)-5-(1-(5-Carboxypentyl)-3,3-dimethylindolin-2-ylidene)penta-1,3-dien-1-yl)-3,3-dimethyl-3H-indol-1-ium-1-yl)butane-1-sulfonate |
|---|---|
| IUPAC Name | 4-((Z)-2-((2E,4E)-5-(1-(5-carboxypentyl)-3,3-dimethyl-3H-indol-1-ium-2-yl)penta-2,4-dien-1-ylidene)-3,3-dimethylindolin-1-yl)butane-1-sulfonate |
| MDL No. | MFCD29904603 |
| Molecular Formula | C35H44N2O5S |
| Molecular Weight | 604.81 |
| SMILES | O=S(CCCC[N+]1=C(/C=C/C=C/C=C2N(CCCCCC(O)=O)C3=C(C=CC=C3)C/2(C)C)C(C)(C)C4=C1C=CC=C4)([O-])=O |
| InChI Key | DLAZDWJBELMOFD-UHFFFAOYSA-N |
| Synonym | Cy5 Acid(mono SO3);S0436;Cy5 Acid(mono SO3) lipo Cy5(C4SO3);4-(2-((1e，3e，5e)-5-(1-(5-cArboxypentyl)-3，3-dimethylindolin-2-ylidene)penta-1，3-dien-1-yl)-3，3-dimethyl-3h-indol-1-ium-1-yl)butane-1-sulfonate |
| CAS No. | 644979-16-8 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H302-H315-H319-H335
- Precautionary Statement(s)
- P261-P280-P301+P312-P302+P352-P305+P351+P338
Synthetic Route by SureRoute
2. ACAHJZ527 Molecular Building Block Synthetic Route
4-(2-((1E,3E)-3-(1-(5-Carboxypentyl)-3,3-dimethylindolin-2-ylidene)prop-1-en-1-yl)-3,3-dimethyl-3H-indol-1-ium-1-yl)butane-1-sulfonate
Sodium 4-(2-(7-(3,3-dimethyl-1-(4-sulfonatobutyl)-3H-indol-1-ium-2-yl)hepta-2,4,6-trien-1-ylidene)-3,3-dimethylindolin-1-yl)butane-1-sulfonate
4-(2-(3-(3,3-Dimethyl-1-(4-sulfobutyl)indolin-2-ylidene)prop-1-en-1-yl)-3,3-dimethyl-3H-indol-1-ium-1-yl)butane-1-sulfonate