1,1,2-Trimethyl-1H-benz[e]indole
- CAS NO.：41532-84-7
- Empirical Formula: C15H15N
- Molecular Weight: 209.29
- MDL number: MFCD00082627
- EINECS: 255-429-8
- SAFETY DATA SHEET (SDS)
- Update Date: 2024-06-06 17:55:34
![1,1,2-Trimethyl-1H-benz[e]indole Structural](https://img.chemicalbook.in/CAS/GIF/41532-84-7.gif)
What is 1,1,2-Trimethyl-1H-benz[e]indole?
Chemical properties
yellow to brown crystalline powder
The Uses of 1,1,2-Trimethyl-1H-benz[e]indole
1,1,2-Trimethyl-1H-benzo[e]indole can be used as an indole pH fluorescent probe and can be used for intracellular pH detection and cell marking. It can also be used as a novel nanocarrier-based near-infrared optical probes for in-vivo tumor imaging.
Synthesis
Isopropyl methyl ketone (9.00 g, 0.1 mol) was added to a solution of 2-naphthylhydrazine hydrochloride (15.80 g, 0.1 mol) in glacial acetic acid (100 mL). The mixture was stirred for 0.5 h at 20 °C and refluxed for 6 h. Then, the reaction mixture was poured onto ice and neutralized with sodium carbonate, a precipitate formed was collected by filtration. The yield was 19.8 g (95%).![1,1,2-Trimethyl-1H-benz[e]indole](/NewsImg/2023-12-07/6383755462801426852705277.jpg "1,1,2-Trimethyl-1H-benz[e]indole")
Properties of 1,1,2-Trimethyl-1H-benz[e]indole
| Melting point: | 111-117 °C |
| Boiling point: | 338.66°C (rough estimate) |
| Density | 0.7 |
| refractive index | 1.5720 (estimate) |
| storage temp. | Inert atmosphere,Room Temperature |
| solubility | insoluble (20°C) |
| form | Crystalline Powder |
| pka | 5.77±0.40(Predicted) |
| color | Yellow to brown |
| Water Solubility | insoluble (20 ºC) |
| BRN | 153709 |
| InChI | InChI=1S/C15H15N/c1-10-15(2,3)14-12-7-5-4-6-11(12)8-9-13(14)16-10/h4-9H,1-3H3 |
| CAS DataBase Reference | 41532-84-7(CAS DataBase Reference) |
| EPA Substance Registry System | 1H-Benz[e]indole, 1,1,2-trimethyl- (41532-84-7) |
Safety information for 1,1,2-Trimethyl-1H-benz[e]indole
| Signal word | Warning |
| Pictogram(s) |
 Exclamation Mark Irritant GHS07 |
| GHS Hazard Statements |
H315:Skin corrosion/irritation H319:Serious eye damage/eye irritation H335:Specific target organ toxicity, single exposure;Respiratory tract irritation |
| Precautionary Statement Codes |
P261:Avoid breathing dust/fume/gas/mist/vapours/spray. P264:Wash hands thoroughly after handling. P264:Wash skin thouroughly after handling. P271:Use only outdoors or in a well-ventilated area. P280:Wear protective gloves/protective clothing/eye protection/face protection. P302+P352:IF ON SKIN: wash with plenty of soap and water. P305+P351+P338:IF IN EYES: Rinse cautiously with water for several minutes. Remove contact lenses, if present and easy to do. Continuerinsing. |
Computed Descriptors for 1,1,2-Trimethyl-1H-benz[e]indole
| InChIKey | WJZSZXCWMATYFX-UHFFFAOYSA-N |
| SMILES | N1C2=C(C3=CC=CC=C3C=C2)C(C)(C)C=1C |
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