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| CAS No.: | 78941-93-2 |
|---|---|
| Name: | 7-CHLORO-8-METHYLQUINOLINE |
| Article Data: | 1 |
| Molecular Structure: | |
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| Formula: | C10H8ClN |
| Molecular Weight: | 177.633 |
| Synonyms: | 7-Chloro-8-methylquinoline; |
| EINECS: | -0 |
| Density: | 1.225 g/cm3 |
| Melting Point: | 45-48 °C |
| Boiling Point: | 277.999 °C at 760 mmHg |
| Flash Point: | 157.512 °C |
| PSA: | 12.89000 |
| LogP: | 3.19660 |
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Specification
The 7-Chloro-8-methylquinoline, with the CAS registry number 78941-93-2, is also known as TX-010745. It belongs to the product categories of Blocks; Quinolines; Quinoline. This chemical's molecular formula is C10H8ClN and molecular weight is 177.63022. Its IUPAC name is called 7-chloro-8-methylquinoline. This chemical can be used as intermediate of herbicide quinclorac. It can be prepared by 3-Chloro-2-methylaniline.
Physical properties of 7-Chloro-8-methylquinoline: (1)ACD/LogP: 3.14; (2)ACD/LogD (pH 5.5): 3; (3)ACD/LogD (pH 7.4): 3; (4)ACD/BCF (pH 5.5): 187; (5)ACD/BCF (pH 7.4): 188; (6)ACD/KOC (pH 5.5): 1466; (7)ACD/KOC (pH 7.4): 1479; (8)#H bond acceptors: 1; (9)Index of Refraction: 1.635; (10)Molar Refractivity: 51.907 cm3; (11)Molar Volume: 144.999 cm3; (12)Surface Tension: 46.562 dyne/cm; (13)Density: 1.225 g/cm3; (14)Flash Point: 157.512 °C; (15)Enthalpy of Vaporization: 49.583 kJ/mol; (16)Boiling Point: 277.999 °C at 760 mmHg; (17)Vapour Pressure: 0.007 mmHg at 25°C.
Uses of 7-Chloro-8-methylquinoline: it can be used to produce 5-bromo-7-chloro-8-methylquinoline at temperature of 20 °C. This reaction will need reagent N-bromosuccinimide with reaction time of 3 hours. The yield is about 93%.
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You can still convert the following datas into molecular structure:
(1)Canonical SMILES: CC1=C(C=CC2=C1N=CC=C2)Cl
(2)InChI: InChI=1S/C10H8ClN/c1-7-9(11)5-4-8-3-2-6-12-10(7)8/h2-6H,1H3
(3)InChIKey: NKWDCLXGUJHNHS-UHFFFAOYSA-N