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101279-39-4

Basic Information
CAS No.: 101279-39-4
Name: Quinoline, 6-(bromomethyl)- (6CI,9CI)
Article Data: 9
Molecular Structure:
Molecular Structure of 101279-39-4 (Quinoline, 6-(bromomethyl)- (6CI,9CI))
Formula: C10H8BrN
Molecular Weight: 222.084
Synonyms: 6-(Bromomethyl)quinoline;NSC 12795;Quinoline, 6-(bromomethyl)- (6CI,9CI);
Density: 1.518 g/cm3
Melting Point: 74-75℃
Boiling Point: 321.9 °C at 760 mmHg
Flash Point: 148.5 °C
PSA: 12.89000
LogP: 3.12970
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Specification

The CAS register number of Quinoline,6-(bromomethyl)- is 101279-39-4. The systematic name about this chemical is 6-(bromomethyl)quinoline. The molecular formula about this chemical is C10H8BrN and the molecular weight is 222.0812. It belongs to the following product category which includes Pyridine.

Physical properties about Quinoline,6-(bromomethyl)- are: (1)ACD/LogP: 2.79; (2)#H bond acceptors: 1; (3)#Freely Rotating Bonds: 1; (4)Polar Surface Area: 12.89 Å2; (5)Index of Refraction: 1.673; (6)Molar Refractivity: 54.83 cm3; (7)Molar Volume: 146.2 cm3; (8)Polarizability: 21.73x10-24cm3; (9)Surface Tension: 52.7 dyne/cm; (10)Density: 1.518 g/cm3; (11)Flash Point: 148.5 °C; (12)Enthalpy of Vaporization: 54.13 kJ/mol; (13)Boiling Point: 321.9 °C at 760 mmHg; (14)Vapour Pressure: 0.000544 mmHg at 25 °C.

You can still convert the following datas into molecular structure:
(1)SMILES: BrCc1ccc2ncccc2c1
(2)InChI: InChI=1/C10H8BrN/c11-7-8-3-4-10-9(6-8)2-1-5-12-10/h1-6H,7H2
(3)InChIKey: ZPTNKPYDDZEAPA-UHFFFAOYAO
(4)Std. InChI: InChI=1S/C10H8BrN/c11-7-8-3-4-10-9(6-8)2-1-5-12-10/h1-6H,7H2
(5)Std. InChIKey: ZPTNKPYDDZEAPA-UHFFFAOYSA-N