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6-Bromo-4-chloro-2-methylquinoline

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Name

6-Bromo-4-chloro-2-methylquinoline

EINECS N/A
CAS No. 53364-85-5 Density 1.591 g/cm3
PSA 12.89000 LogP 3.95910
Solubility N/A Melting Point 75 °C
Formula C10H7BrClN Boiling Point 321.9 °C at 760 mmHg
Molecular Weight 256.529 Flash Point 148.5 °C
Transport Information N/A Appearance N/A
Safety 26-39-45 Risk Codes 25-41
Molecular Structure Molecular Structure of 53364-85-5 (6-BROMO-4-CHLORO-2-METHYLQUINOLINE) Hazard Symbols IrritantXi
Synonyms

Quinaldine,6-bromo-4-chloro- (4CI);6-Bromo-4-chloro-2-methylquinoline;

Article Data 8

6-Bromo-4-chloro-2-methylquinoline Specification

This chemical has the systematic name 6-Bromo-4-chloro-2-methylquinoline. With the CAS registry number of 53364-85-5, it's also named as quinoline, 6-bromo-4-chloro-2-methyl-. Its molecular formula is C10H7BrClN and its molecular weight is 256.53.

Physical properties about 6-Bromo-4-chloro-2-methylquinoline are: (1)ACD/LogP: 3.99; (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: 1.661; (8)Molar Refractivity: 59.59 cm3; (9)Molar Volume: 161.1 cm3; (10)Polarizability: 23.62×10-24cm3; (11)Surface Tension: 50.3 dyne/cm; (12)Density: 1.591 g/cm3; (13)Flash Point: 148.5 °C; (14)Enthalpy of Vaporization: 54.12 kJ/mol; (15)Boiling Point: 321.9 °C at 760 mmHg; (16)Vapour Pressure: 0.000546 mmHg at 25°C.

Uses of . This reaction needs the reagent of conc. H2SO4, HNO3. The yield is 51 %. In addition, this reaction should be taken for 3 hours at the temperature of -5-20 °C.

the 6-Bromo-4-chloro-2-methylquinoline could be used to produce the 6-bromo-2-methyl-5-nitro-4-chloroquinoline

You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccc2nc(cc(Cl)c2c1)C;
(2)InChI: InChI=1/C10H7BrClN/c1-6-4-9(12)8-5-7(11)2-3-10(8)13-6/h2-5H,1H3;
(3)InChIKey: OCNREXWJWVKEEB-UHFFFAOYAD;
(4)Std. InChI: InChI=1S/C10H7BrClN/c1-6-4-9(12)8-5-7(11)2-3-10(8)13-6/h2-5H,1H3;
(5)Std. InChIKey: OCNREXWJWVKEEB-UHFFFAOYSA-N

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