Ethanone,1-(6-amino-2,3-dihydro-1H-indol-1-yl)- (62368-29-0)

The IUPAC name of Ethanone,1-(6-amino-2,3Å-dihydro-1H-indol-1-yl)- is 1-(6-amino-2,3-dihydroindol-1-yl)ethanone. With the CAS registry number 62368-29-0, it is also named as 1-Acetyl-6-amino-2,3-dihydro-1H-indole. The product's categories are Heterocyclic Compounds; Building Blocks; Heterocyclic Building Blocks; Indoles; Building Blocks. Besides, it is yellow to tan powder, which should be stored at 2-8 °C. In addition, its molecular formula is C₁₀H₁₂N₂O and molecular weight is 176.21. Moreover, this chemical is harmful if swallowed.

The other characteristics of this product can be summarized as: (1)ACD/LogP: 0.48; (2)# of Rule of 5 Violations: 0; (3)H bond acceptors: 3; (4)H bond donors: 2; (5)Freely Rotating Bonds: 1; (6)Polar Surface Area: 23.55 Å²; (7)Index of Refraction: 1.628; (8)Molar Refractivity: 50.82 cm³; (9)Molar Volume: 143.1 cm³; (10)Polarizability: 20.14×10^-24cm³; (11)Surface Tension: 56.3 dyne/cm; (12)Density: 1.231 g/cm³; (13)Flash Point: 227.9 °C; (14)Melting Point: 182 °C; (15)Enthalpy of Vaporization: 71.26 kJ/mol; (16)Boiling Point: 453.2 °C at 760 mmHg; (17)Vapour Pressure: 2.11E-08 mmHg at 25 °C.

Uses of Ethanone,1-(6-amino-2,3-dihydro-1H-indol-1-yl)-: it can react with 2-Bromo-1,1-diethoxy-ethane to get N-(1-Acetyl-6-indolinyl)-2,2-diethoxyethylamine.



This reaction needs K₂CO₃ and Dimethylformamide at temperature of 100 °C for 18 hours. The yield is 39 %.

People can use the following data to convert to the molecule structure.
(1)SMILES:O=C(N2c1cc(ccc1CC2)N)C
(2)InChI:InChI=1/C10H12N2O/c1-7(13)12-5-4-8-2-3-9(11)6-10(8)12/h2-3,6H,4-5,11H2,1H3
(3)InChIKey:LOZKZWIQDVEDCQ-UHFFFAOYAR
(4)Std. InChI:InChI=1S/C10H12N2O/c1-7(13)12-5-4-8-2-3-9(11)6-10(8)12/h2-3,6H,4-5,11H2,1H3
(5)Std. InChIKey:LOZKZWIQDVEDCQ-UHFFFAOYSA-N