Account 4-(2-(2-(2-Chloro-3-(2-(1-(4-sulfobutyl)benzo[cd]indol-2(1H)-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)benzo[cd]indol-1-ium-1-yl)butane-1-sulfonate
- Catalog No. :
- ACNSDU092
- CAS No. :
- 1151888-25-3
- Molecular Formula :
- C40H39ClN2O6S2
- Molecular Weight :
- 743.35
IUPAC Name:4-((Z)-2-((E)-2-(2-chloro-3-((E)-2-(1-(4-sulfobutyl)benzo[cd]indol-1-ium-2-yl)vinyl)cyclohex-2-en-1-ylidene)ethylidene)benzo[cd]indol-1(2H)-yl)butane-1-sulfonate
![4-(2-(2-(2-Chloro-3-(2-(1-(4-sulfobutyl)benzo[cd]indol-2(1H)-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)benzo[cd]indol-1-ium-1-yl)butane-1-sulfonate structure diagram](/images/productimg/no-pic.svg)
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Product Information
| Product Name | 4-(2-(2-(2-Chloro-3-(2-(1-(4-sulfobutyl)benzo[cd]indol-2(1H)-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)benzo[cd]indol-1-ium-1-yl)butane-1-sulfonate |
|---|---|
| IUPAC Name | 4-((Z)-2-((E)-2-(2-chloro-3-((E)-2-(1-(4-sulfobutyl)benzo[cd]indol-1-ium-2-yl)vinyl)cyclohex-2-en-1-ylidene)ethylidene)benzo[cd]indol-1(2H)-yl)butane-1-sulfonate |
| Molecular Formula | C40H39ClN2O6S2 |
| Molecular Weight | 743.35 |
| SMILES | O=S(CCCC[N+]1=C(C=CC2=C(Cl)C(CCC2)=CC=C3N(CCCCS(=O)(O)=O)C4=C5C3=CC=CC5=CC=C4)C6=CC=CC7=C6C1=CC=C7)([O-])=O |
| InChI Key | NDZQFRYUXBSGNX-UHFFFAOYSA-N |
| Synonym | FD-1080 Cl;FD-1080 Free Acid;4-(2-(2-(2-Chloro-3-(2-(1-(4-sulfobutyl)benzo[cd]indol-2(1H)-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)benzo[cd]indol-1-ium-1-yl)butane-1-sulfonate;FD-1080 Acid |
| CAS No. | 1151888-25-3 |
Safety Data
- Pictogram
- Signal Word
- Warning
- 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. ACNSDU092 Molecular Building Block Synthetic Route
Sodium 4-(2-(2-(2-chloro-3-(2-(1-(4-sulfonatobutyl)benzo[cd]indol-1-ium-2-yl)vinyl)cyclohex-2-en-1-ylidene)ethylidene)benzo[cd]indol-1(2H)-yl)butane-1-sulfonate
1-Butyl-2-(2-[3-[2-(1-butyl-1H-benzo[cd]indol-2-ylidene)ethylidene]-2-chloro-cyclohex-1-enyl]vinyl)benzo[cd]indolium tetrafluoroborate
1-Butyl-2-(2-(3-(2-(1-butyl-6-chlorobenzo[cd]indol-2(1H)-ylidene)ethylidene)-2-chlorocyclohex-1-en-1-yl)vinyl)-6-chlorobenzo[cd]indol-1-ium tetrafluoroborate