| Identification | More | [Name]
4-Benzyloxyindole | [CAS]
20289-26-3 | [Synonyms]
4-BENZYLOXY-1H-INDOLE
4-BENZYLOXYINDOLE
4-BENZYLOXYLINDOLE
4-(phenylmethoxy)-1h-indole
NSC 92539
4-BENZYLOXYINDOLE 98%
4-Benzyloxyindole ,98% | [EINECS(EC#)]
243-690-0 | [Molecular Formula]
C15H13NO | [MDL Number]
MFCD00047200 | [Molecular Weight]
223.27 | [MOL File]
20289-26-3.mol |
| Chemical Properties | Back Directory | [Appearance]
Off-White Crystalline Solid with Few Darker (Brown) Particles | [Melting point ]
57-61 °C (lit.) | [Boiling point ]
364.56°C (rough estimate) | [density ]
1.0707 (rough estimate) | [refractive index ]
1.5500 (estimate) | [storage temp. ]
Sealed in dry,Room Temperature | [pka]
17.17±0.30(Predicted) | [Usage]
Indole derivative as substrate-binding; N297Q and I300V mutants of cytochrome P 450 2A6 display expansion of substrate specificity of cytochrome P 450 2A6 to oxidize substituted indoles | [Detection Methods]
HPLC,NMR | [BRN ]
183150 | [CAS DataBase Reference]
20289-26-3(CAS DataBase Reference) |
| Safety Data | Back Directory | [Hazard Codes ]
Xi | [Risk Statements ]
R36/37/38:Irritating to eyes, respiratory system and skin . | [Safety Statements ]
S26:In case of contact with eyes, rinse immediately with plenty of water and seek medical advice .
S36:Wear suitable protective clothing .
S37/39:Wear suitable gloves and eye/face protection . | [WGK Germany ]
3
| [Hazard Note ]
Irritant | [HazardClass ]
IRRITANT | [HS Code ]
29339900 |
| Hazard Information | Back Directory | [Chemical Properties]
Off-White Crystalline Solid with Few Darker (Brown) Particles | [Uses]
4-Benzyloxyindole was used in the synthesis of 4-alkyloxy-aminoalkyl indole derivatives. | [Uses]
Indole derivative as substrate-binding; N297Q and I300V mutants of cytochrome P 450 2A6 display expansion of substrate specificity of cytochrome P 450 2A6 to oxidize substituted indoles | [Synthesis Reference(s)]
Organic Syntheses, Coll. Vol. 7, p. 34, 1990
The Journal of Organic Chemistry, 51, p. 4294, 1986 DOI: 10.1021/jo00372a037
Tetrahedron Letters, 24, p. 4561, 1983 DOI: 10.1016/S0040-4039(00)85955-9 |
| Questions and Answers (Q&A) | Back Directory | [Reactions]
4-Benzyloxyindole was used in the synthesis of 4-alkyloxy-aminoalkyl indole derivatives.
- Reactant for regioselective synthesis of oxopyrrolidine analogs via iodine-catalyzed Markovnikov addition
- Reactant for preparation of indoles by Bartoli reductive cyclization as useful intermediates in medicinal chemistry research
- Reactant for synthesis of carbon-11-labeled 4-aryl-4H-chromenes as new PET agents for imaging of apoptosis in cancer
- Reactant for preparation of HCV inhibitors.
- Reactant for preparation of indol-3-yl tetramethylcyclopropyl ketones as CB2 cannabinoid receptor ligands
- Reactant for preparation of 4-aryl-4H-chromenes as apoptosis inducers
|
|
|