Account N-[4-[[4-[(4-Ethoxyphenyl)amino]phenyl][4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfo-benzenemethanaminium inner salt, sodium salt (1:1)
- Catalog No. :
- ACHXKD789
- CAS No. :
- 6104-59-2
- Molecular Formula :
- C45H44N3NaO7S2
- Molecular Weight :
- 825.98
IUPAC Name:sodium 3-(((4-((4-((4-ethoxyphenyl)amino)phenyl)(4-(ethyl(3-sulfonatobenzyl)amino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)ammonio)methyl)benzenesulfonate
![N-[4-[[4-[(4-Ethoxyphenyl)amino]phenyl][4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfo-benzenemethanaminium inner salt, sodium salt (1:1) structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | N-[4-[[4-[(4-Ethoxyphenyl)amino]phenyl][4-[ethyl[(3-sulfophenyl)methyl]amino]phenyl]methylene]-2,5-cyclohexadien-1-ylidene]-N-ethyl-3-sulfo-benzenemethanaminium inner salt, sodium salt (1:1) |
|---|---|
| IUPAC Name | sodium 3-(((4-((4-((4-ethoxyphenyl)amino)phenyl)(4-(ethyl(3-sulfonatobenzyl)amino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)ammonio)methyl)benzenesulfonate |
| MDL No. | MFCD00041762 |
| Molecular Formula | C45H44N3NaO7S2 |
| Molecular Weight | 825.98 |
| SMILES | S(=O)(=O)([O-])C1(=CC(=CC=C1)C[N+](=C6(C=CC(=C(C3(=CC=C(N(CC2(=CC(S(=O)(=O)[O-])=CC=C2))CC)C=C3))C5(=CC=C(NC4(=CC=C(OCC)C=C4))C=C5))C=C6))CC).[Na+] |
| InChI Key | NKLPQNGYXWVELD-UHFFFAOYSA-M |
| Synonym | Acid Cyanine 6B | Acid Blue 83 | Coomassie blue R-250 | Alizarin Rubinol 5G | Coomassie Brilliant Blue R-250 | Solar Cyanine 6B | CBB R-250 |
| CAS No. | 6104-59-2 |
| PubChem CID | 61365 |
Safety Data
- Pictogram
- Signal Word
- Danger
- Hazard Statement(s)
- H301+H311+H331-H315-H319-H370
- Precautionary Statement(s)
- P261-P280-P301+P310-P305+P351+P338-P307+P311
Synthetic Route by SureRoute
2. ACHXKD789 Molecular Building Block Synthetic Route
sodium 3-((ethyl(4-((4-(ethyl(3-sulfonatobenzyl)amino)phenyl)(phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)ammonio)methyl)benzenesulfonate
sodium 3-(((4-((4-(dimethylamino)phenyl)(4-(ethyl(3-sulfonatobenzyl)amino)phenyl)methylene)cyclohexa-2,5-dien-1-ylidene)(ethyl)ammonio)methyl)benzenesulfonate
AcidViolet17