Account 2-(2-(2-Chloro-3-(2-(3,3-dimethyl-1-propylindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-3,3-dimethyl-1-propyl-3H-indol-1-ium iodide
- Catalog No. :
- ACPRCH602
- CAS No. :
- 207399-07-3
- Molecular Formula :
- C36H44ClIN2
- Molecular Weight :
- 667.12
IUPAC Name:2-(2-((E)-2-chloro-3-(2-((E)-3,3-dimethyl-1-propylindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-3,3-dimethyl-1-propyl-3H-indol-1-ium iodide
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Product Information
| Product Name | 2-(2-(2-Chloro-3-(2-(3,3-dimethyl-1-propylindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-3,3-dimethyl-1-propyl-3H-indol-1-ium iodide |
|---|---|
| IUPAC Name | 2-(2-((E)-2-chloro-3-(2-((E)-3,3-dimethyl-1-propylindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-3,3-dimethyl-1-propyl-3H-indol-1-ium iodide |
| MDL No. | MFCD00191907 |
| Molecular Formula | C36H44ClIN2 |
| Molecular Weight | 667.12 |
| SMILES | C(N1/C(/C(C2=CC=CC=C12)(C)C)=C/C=C1\CCCC(=C\1Cl)C=CC1C(C2=CC=CC=C2[N+]=1CCC)(C)C)CC.[I-] |
| InChI Key | IRPKBYJYVJOQHQ-UHFFFAOYSA-M |
| Synonym | IR-780 iodide | 2-[2-[2-Chloro-3-[(1,3-dihydro-3,3-dimethyl-1-propyl-2H-indol-2-ylidene)ethylidene]-1-cyclohexen-1-yl]ethenyl]-3,3-dimethyl-1-propylindolium iodide | 11-Chloro-1,1'-di-n-propyl-3,3,3',3'-tetramethyl-10,12-trimethyleneindatricarbocyanine io |
| CAS No. | 207399-07-3 |
| PubChem CID | 44669080 |
Safety Data
- Pictogram
- Signal Word
- Achtung
- Hazard Statement(s)
- H315-H319-H335
- Precautionary Statement(s)
- P261-P264-P271-P280-P302+P352-P304+P340-P305+P351+P338-P312-P362-P403+P233-P501
Synthetic Route by SureRoute
2. ACPRCH602 Molecular Building Block Synthetic Route
2-(2-(2-Chloro-3-(2-(1-ethyl-3,3-dimethylindolin-2-ylidene)ethylidene)cyclohex-1-en-1-yl)vinyl)-1-ethyl-3,3-dimethyl-3H-indol-1-ium iodide
1-(5-Carboxypentyl)-2-(2-(3-(2-(1-(5-carboxypentyl)-3,3-dimethylindolin-2-ylidene)ethylidene)-2-chlorocyclohex-1-en-1-yl)vinyl)-3,3-dimethyl-3H-indol-1-ium bromide
1-(5-Carboxypentyl)-2-((E)-2-((E)-3-(2-((E)-1-(5-carboxypentyl)-3,3-dimethylindolin-2-ylidene)ethylidene)-2-chlorocyclohex-1-en-1-yl)vinyl)-3,3-dimethyl-3H-indol-1-ium