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5-Acetyl-8-(phenylmethoxy)-2-quinolinone

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Name

5-Acetyl-8-(phenylmethoxy)-2-quinolinone

EINECS 618-957-3
CAS No. 93609-84-8 Density 1.231 g/cm3
PSA 59.42000 LogP 3.72200
Solubility N/A Melting Point 174-176 °C
Formula C18H15NO3 Boiling Point 569.179 °C at 760 mmHg
Molecular Weight 293.322 Flash Point 298.029 °C
Transport Information N/A Appearance N/A
Safety Risk Codes N/A
Molecular Structure Molecular Structure of 93609-84-8 (5-Acetyl-8-(phenylmethoxy)-2-quinolinone) Hazard Symbols N/A
Synonyms

1-[8-(Benzyloxy)-2-hydroxyquinolin-5-yl]ethanone;

Article Data 19

5-Acetyl-8-(phenylmethoxy)-2-quinolinone Specification

The 5-Acetyl-8-(phenylmethoxy)-2-quinolinone, with the CAS registry number 93609-84-8, is also known as 1-[8-(Benzyloxy)-2-hydroxyquinolin-5-yl]ethanone. It belongs to the product categories of Aromatics; Heterocycles; Intermediates & Fine Chemicals; Pharmaceuticals. This chemical's molecular formula is C18H15NO3 and molecular weight is 293.00. What's more, its systematic name is called 5-Acetyl-8-(benzyloxy)-2(1H)-quinolinone.

Physical properties about 5-Acetyl-8-(phenylmethoxy)-2-quinolinone are: (1)ACD/LogP: 2.829; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.83; (4)ACD/LogD (pH 7.4): 2.83; (5)ACD/BCF (pH 5.5): 83.20; (6)ACD/BCF (pH 7.4): 83.14; (7)ACD/KOC (pH 5.5): 824.17; (8)ACD/KOC (pH 7.4): 823.57; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 55.4 Å2; (13)Index of Refraction: 1.611; (14) Molar Refractivity: 82.703 cm3; (15)Molar Volume: 238.321 cm3; (16)Polarizability: 32.786×10-24cm3; (17)Surface Tension: 48.690 dyne/cm; (18)Density: 1.231 g/cm3; (19)Flash Point: 298.029 °C; (20)Enthalpy of Vaporization: 85.4 kJ/mol; (21)Boiling Point: 569.179 °C at 760 mmHg; (22)Vapour Pressure: 0 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1) SMILES: CC(=O)c3ccc(OCc1ccccc1)c2NC(=O)\C=C/c23
(2) InChI: InChI=1S/C18H15NO3/c1-12(20)14-7-9-16(18-15(14)8-10-17(21)19-18)22-11-13-5-3-2-4-6-13/h2-10H,11H2,1H3,(H,19,21)
(3) InChIKey: MVYPGJMOODJFAZ-UHFFFAOYSA-N

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