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| CAS No.: | 55934-22-0 |
|---|---|
| Name: | 2,4-DICHLORO-7-METHOXY QUINOLINE |
| Article Data: | 11 |
| Molecular Structure: | |
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| Formula: | C10H7Cl2NO |
| Molecular Weight: | 228.078 |
| Synonyms: | 2,4-Dichloro-7-methoxyquinoline;2,4-Dichloro-7-methoxy quinoline;2,4-Dichloro-7-methoxy-quinoline; |
| Density: | 1.384 g/cm3 |
| Melting Point: | 132-133 °C(Solv: ethanol (64-17-5)) |
| Boiling Point: | 327.9 °C at 760 mmHg |
| Flash Point: | 152.1 °C |
| PSA: | 22.12000 |
| LogP: | 3.55020 |
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Specification
The Quinoline, 2,4-dichloro-7-methoxy-, with the CAS registry number 55934-22-0, has the systematic name of 2,4-dichloro-7-methoxyquinoline. It is a kind of organics, and should be stored in the dry and cool environment. And the molecular formula of the chemical is C10H7Cl2NO.
The characteristics of Quinoline, 2,4-dichloro-7-methoxy- are as followings: (1)ACD/LogP: 3.67; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 3.67; (4)ACD/LogD (pH 7.4): 3.67; (5)ACD/BCF (pH 5.5): 361.93; (6)ACD/BCF (pH 7.4): 361.93; (7)ACD/KOC (pH 5.5): 2360.85; (8)ACD/KOC (pH 7.4): 2360.85; (9)#H bond acceptors: 2; (10)#H bond donors: 0; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 22.12 Å2; (13)Index of Refraction: 1.63; (14)Molar Refractivity: 58.65 cm3; (15)Molar Volume: 164.6 cm3; (16)Polarizability: 23.25×10-24cm3; (17)Surface Tension: 48 dyne/cm; (18)Density: 1.384 g/cm3; (19)Flash Point: 152.1 °C; (20)Enthalpy of Vaporization: 54.76 kJ/mol; (21)Boiling Point: 327.9 °C at 760 mmHg; (22)Vapour Pressure: 0.000374 mmHg at 25°C.
Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: COc1cc2nc(Cl)cc(Cl)c2cc1
(2)InChI: InChI=1/C10H7Cl2NO/c1-14-6-2-3-7-8(11)5-10(12)13-9(7)4-6/h2-5H,1H3
(3)InChIKey: XHKVDLMHZLUDSK-UHFFFAOYAQ