Basic Information | Post buying leads | Suppliers | Cas Database |
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 | Hazard Symbols | Xi | |
Synonyms |
Quinaldine,6-bromo-4-chloro- (4CI);6-Bromo-4-chloro-2-methylquinoline; |
Article Data | 8 |
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.
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