| | Identification | More |  | [Name] 
 1,1,2-Trimethyl-1H-benz[e]indole
 |  | [CAS] 
 41532-84-7
 |  | [Synonyms] 
 1,1,2-TRIMETHYL-1H-BENZ[E]INDOLE
 1,1,2-TRIMETHYL-1H-BENZO[E]INDOLE
 1,1,2-TRIMETHYLBENZ[E]INDOLE
 1,1,2-TRIMETHYLBENZO[E]INDOLE
 1,1,2-TRIMETHYLNAPHTHO[1,2-D]PYRROLE
 1H-BENZO[E]INDOLE, 1,1,2-TRIMETHYL-
 2,3,3-TRIMETHYL-3H-BENZ[E]INDOL
 2,3,3-TRIMETHYL-3H-BENZO[E]INDOLE
 2,3,3-TRIMETHYL-4,5-BENZO-3H-INDOLE
 2,3,3-TRIMETHYL-4,5-BENZOINDOLENINE
 2,3,3-TRIMETHYLBENZO[E]INDOLENINE
 2,3,3-TRIMETHYLBENZOINDOLENINE
 2,3,3-TRIMETHYLNAPHTO[1,2-D]PYRROLE
 AKOS BBS-00006363
 TMBI
 1,1,2-trimethyl-1h-benz[e]indol
 1,1,2-TRIMEHTYL-1H-BENZ[E]INDOLE
 2,3,3-Trimethyl-1H-Benzo(E)Indole
 1,2,2-Trimethyl-1H-benz[e]indole
 2,3,3-trimethylnaphtho[1,2-d]pyrrole
 |  | [EINECS(EC#)] 
 255-429-8
 |  | [Molecular Formula] 
 C15H15N
 |  | [MDL Number] 
 MFCD00082627
 |  | [Molecular Weight] 
 209.29
 |  | [MOL File] 
 41532-84-7.mol
 | 
 | Chemical Properties | Back Directory |  | [Appearance] 
 yellow to brown crystalline powder
 |  | [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)
 |  | [Detection Methods] 
 HPLC,NMR
 |  | [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
 |  | [InChIKey] 
 WJZSZXCWMATYFX-UHFFFAOYSA-N
 |  | [SMILES] 
 N1C2=C(C3=CC=CC=C3C=C2)C(C)(C)C=1C
 |  | [CAS DataBase Reference] 
 41532-84-7(CAS DataBase Reference)
 |  | [Storage Precautions] 
 Store under nitrogen
 |  | [EPA Substance Registry System] 
 1H-Benz[e]indole, 1,1,2-trimethyl- (41532-84-7)
 | 
 | Safety Data | Back Directory |  | [Hazard Codes ] 
 Xi,T
 |  | [Risk Statements ] 
 R36/37/38:Irritating to eyes, respiratory system and skin .
 R45:May cause cancer.
 |  | [Safety Statements ] 
 S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
 S36:Wear suitable protective clothing .
 S53:Avoid exposure-obtain special instruction before use .
 S45:In case of accident or if you feel unwell, seek medical advice immediately (show label where possible) .
 S37/39:Wear suitable gloves and eye/face protection .
 |  | [WGK Germany ] 
 3
 
 |  | [TSCA ] 
 Yes
 |  | [HS Code ] 
 29339900
 | 
 | Hazard Information | Back Directory |  | [Chemical Properties] 
 yellow to brown crystalline powder
 |  | [Uses] 
 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 1,1,2-Trimethyl-1H-benz[e]indole](/NewsImg/2023-12-07/6383755462801426852705277.jpg) |  | [References] 
 [1] Russian Chemical Bulletin,  2016,  vol. 65,  # 11,  p. 2722 - 2728
 [2] Izv. Akad. Nauk, Ser. Khim.,  2016,  # 11,  p. 2722 - 2728,7
 | 
 | Spectrum Detail | Back Directory |  | [Spectrum Detail] 
 1,1,2-Trimethyl-1H-benz[e]indole(41532-84-7)MS
 1,1,2-Trimethyl-1H-benz[e]indole(41532-84-7)1HNMR
 1,1,2-Trimethyl-1H-benz[e]indole(41532-84-7)13CNMR
 1,1,2-Trimethyl-1H-benz[e]indole(41532-84-7)IR1
 1,1,2-Trimethyl-1H-benz[e]indole(41532-84-7)IR2
 
 | 
 | Well-known Reagent Company Product Information | Back Directory |  | [Acros Organics] 
 1,1,2-Trimethyl-1H-benz[e]indole, 96%(41532-84-7)
 |  | [Alfa Aesar] 
 1,1,2-Trimethyl-1H-benz[e]indole, 97%(41532-84-7)
 |  | [Sigma Aldrich] 
 41532-84-7(sigmaaldrich)
 |  | [TCI AMERICA] 
 2,3,3-Trimethyl-4,5-benzo-3H-indole,>97.0%(T)(41532-84-7)
 | 
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