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HomeProduct name list1,1,2-Trimethyl-1H-benz[e]indole

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

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

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)
ghs
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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