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CAS No.: | 139719-24-7 |
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Name: | 2-Chloro-4,6,8-trimethyl-quinoline |
Molecular Structure: | |
Formula: | C12H12ClN |
Molecular Weight: | 205.69 |
Synonyms: | 2-Chloro-4,6,8-trimethyl-quinoline; quinoline, 2-chloro-4,6,8-trimethyl- |
Density: | 1.158 g/cm3 |
Boiling Point: | 326.5 °C at 760 mmHg |
Flash Point: | 181.1 °C |
PSA: | 12.89000 |
LogP: | 3.81340 |
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This chemical is called 2-Chloro-4,6,8-trimethyl-quinoline, and it can also be named as quinoline, 2-chloro-4,6,8-trimethyl-. With the molecular formula of C12H12ClN, its molecular weight is 205.69. The CAS registry number of this chemical is 139719-24-7.
Other characteristics of the 2-Chloro-4,6,8-trimethyl-quinoline can be summarised as followings: (1)ACD/LogP: 4.09; (2)# of Rule of 5 Violations: 0; (3)#H bond acceptors: 1; (4)#H bond donors: 0; (5)#Freely Rotating Bonds: 0; (6)Polar Surface Area: 12.89 Å2; (7)Index of Refraction: 1.609; (8)Molar Refractivity: 61.55 cm3; (9)Molar Volume: 177.5 cm3; (10)Polarizability: 24.4×10-24cm3; (11)Surface Tension: 42.7 dyne/cm; (12)Density: 1.158 g/cm3; (13)Flash Point: 181.1 °C; (14)Enthalpy of Vaporization: 54.61 kJ/mol; (15)Boiling Point: 326.5 °C at 760 mmHg; (16)Vapour Pressure: 0.000409 mmHg at 25°C.
You can still convert the following datas into molecular structure:
1.SMILES: Clc1nc2c(cc(cc2c(c1)C)C)C
2.InChI: InChI=1/C12H12ClN/c1-7-4-9(3)12-10(5-7)8(2)6-11(13)14-12/h4-6H,1-3H3
3.InChIKey: QELGNYILIXTHBQ-UHFFFAOYAS