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CAS No.: | 5883-96-5 |
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Name: | 1H-INDOLE, 5-METHOXY-2-PHENYL- |
Article Data: | 75 |
Molecular Structure: | |
Formula: | C15H13NO |
Molecular Weight: | 223.274 |
Synonyms: | 5-Methoxy-2-phenylindole;5-Methoxy-2-phenyl-1H-indole;2-Phenyl-5-methoxyindole; |
Density: | 1.167 g/cm3 |
Boiling Point: | 427.2 °C at 760 mmHg |
Flash Point: | 154.1 °C |
PSA: | 25.02000 |
LogP: | 3.84350 |
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The 1H-Indole, 5-methoxy-2-phenyl-, with the CAS registry number 5883-96-5, is also known as 5-Methoxy-2-phenylindole. This chemical's molecular formula is C15H13NO and molecular weight is 223.27. What's more, its IUPAC name is 5-Methoxy-2-phenyl-1H-indole.
Physical properties about 1H-Indole, 5-methoxy-2-phenyl- are: (1)ACD/LogP: 4.59; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 1; (5)#Freely Rotating Bonds: 2; (6)Polar Surface Area: 14.16 Å2; (7)Index of Refraction: 1.65; (8)Molar Refractivity: 69.79 cm3; (9)Molar Volume: 191.1 cm3; (10)Polarizability: 27.67×10-24 cm3; (11)Surface Tension: 47 dyne/cm; (12)Density: 1.167 g/cm3; (13)Flash Point: 154.1 °C; (14)Enthalpy of Vaporization: 65.57 kJ/mol; (15)Boiling Point: 427.2 °C at 760 mmHg; (16)Vapour Pressure: 4.16E-07 mmHg at 25 °C.
Preparation of 1H-Indole, 5-methoxy-2-phenyl-: this chemical is prepared by Acetophenone-(4-methoxy-phenylhydrazone). This reaction needs AMFK catalyst. The reaction temperature is 200-280 °C. The yield is about 70 %.
Uses of 1H-Indole, 5-methoxy-2-phenyl-: it is used to produce other chemicals. For example, it is used to produce 2-Phenyl-indol-5-ol. The reaction needs reagent BBr3. The yield is about 92 %.
You can still convert the following datas into molecular structure:
(1) SMILES: O(c1cc2c(cc1)nc(c2)c3ccccc3)C
(2) InChI: InChI=1/C15H13NO/c1-17-13-7-8-14-12(9-13)10-15(16-14)11-5-3-2-4-6-11/h2-10,16H,1H3
(3) InChIKey: XLYAWBZMLNSOBU-UHFFFAOYAY