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CAS No.: | 4169-19-1 |
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Name: | 1,2,3,4-TETRAHYDRO-1-ACETYLQUINOLINE |
Article Data: | 23 |
Molecular Structure: | |
Formula: | C11H13NO |
Molecular Weight: | 175.23 |
Synonyms: | Acetyltetrahydroquinoline;Cuzol A;N-Acetyl-1,2,3,4-tetrahydroquinoline;NSC 406746;1-Acetyl-1,2,3,4-tetrahydroquinoline;Quinoline,1-acetyl-1,2,3,4-tetrahydro- (6CI,7CI,8CI,9CI); |
Density: | 1.105 g/cm3 |
Boiling Point: | 371.1 °C at 760 mmHg |
Flash Point: | 181.1 °C |
PSA: | 20.31000 |
LogP: | 2.05070 |
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The Ethanone,1-(3,4-dihydro-1(2H)-quinolinyl)-, with the CAS registry number 4169-19-1, is also known as N-Acetyl-1,2,3,4-tetrahydroquinoline. This chemical's molecular formula is C11H13NO and molecular weight is 175.23. What's more, its IUPAC name is 1-(3,4-Dihydro-2H-quinolin-1-yl)ethanone. Additionally, it should be preserved hermetically and put in a cool, dry place.
Physical properties about Ethanone,1-(3,4-dihydro-1(2H)-quinolinyl)-: (1)ACD/LogP: 2.27; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 2; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 20.31 Å2; (7)Index of Refraction: 1.558; (8)Molar Refractivity: 51.19 cm3; (9)Molar Volume: 158.5 cm3; (10)Surface Tension: 42.1 dyne/cm; (11)Density: 1.105 g/cm3; (12)Flash Point: 181.1 °C; (13)Enthalpy of Vaporization: 61.81 kJ/mol; (14)Boiling Point: 371.1 °C at 760 mmHg; (15)Vapour Pressure: 1.05E-05 mmHg at 25 °C.
You can still convert the following datas into molecular structure:
(1) SMILES: O=C(N2c1ccccc1CCC2)C
(2) InChI: InChI=1/C11H13NO/c1-9(13)12-8-4-6-10-5-2-3-7-11(10)12/h2-3,5,7H,4,6,8H2,1H3
(3) InChIKey: RRWLNRQGJSQRAF-UHFFFAOYAL