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CAS No.: | 409346-70-9 |
---|---|
Name: | 6-BROMO-2-CHLORO-3-ETHYLQUINOLINE |
Article Data: | 2 |
Molecular Structure: | |
Formula: | C11H9BrClN |
Molecular Weight: | 270.556 |
Synonyms: | 6-Bromo-2-chloro-3-ethyl-quinoline; |
Density: | 1.522 g/cm3 |
Boiling Point: | 345.5 °C at 760 mmHg |
Flash Point: | 162.8 °C |
PSA: | 12.89000 |
LogP: | 4.21310 |
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The CAS register number of Quinoline,6-bromo-2-chloro-3-ethyl- is 409346-70-9. It also can be called as 6-Bromo-2-chloro-3-ethyl-quinoline and the IUPAC name about this chemical is 6-bromo-2-chloro-3-ethylquinoline. The molecular formula about this chemical is C11H9BrClN and the molecular weight is 270.55286.
Physical properties about Quinoline,6-bromo-2-chloro-3-ethyl- are: (1)ACD/LogP: 4.45; (2)ACD/LogD (pH 5.5): 4.45; (3)ACD/LogD (pH 7.4): 4.45; (4)ACD/BCF (pH 5.5): 1412.83; (5)ACD/BCF (pH 7.4): 1412.84; (6)ACD/KOC (pH 5.5): 6257.97; (7)ACD/KOC (pH 7.4): 6257.98; (8)#H bond acceptors: 1; (9)#Freely Rotating Bonds: 1; (10)Polar Surface Area: 12.89Å2; (11)Index of Refraction: 1.643; (12)Molar Refractivity: 64.32 cm3; (13)Molar Volume: 177.7 cm3; (14)Polarizability: 25.49x10-24cm3; (15)Surface Tension: 48.1 dyne/cm; (16)Flash Point: 162.8 °C; (17)Enthalpy of Vaporization: 56.63 kJ/mol; (18)Boiling Point: 345.5 °C at 760 mmHg; (19)Vapour Pressure: 0.000122 mmHg at 25°C.
You can still convert the following datas into molecular structure:
(1)SMILES: Brc1ccc2nc(Cl)c(cc2c1)CC
(2)InChI: InChI=1/C11H9BrClN/c1-2-7-5-8-6-9(12)3-4-10(8)14-11(7)13/h3-6H,2H2,1H3
(3)InChIKey: RDBIGYMOEAEGJM-UHFFFAOYAF
(4)Std. InChI: InChI=1S/C11H9BrClN/c1-2-7-5-8-6-9(12)3-4-10(8)14-11(7)13/h3-6H,2H2,1H3
(5)Std. InChIKey: RDBIGYMOEAEGJM-UHFFFAOYSA-N