5-Quinolinamine,6-bromo- (50358-39-9)

The 5-Amino-6-bromoquinoline with the CAS number 50358-39-9 is also called 5-Quinolinamine,6-bromo-. The systematic name is 6-bromoquinolin-5-amine. Its molecular formula is C₉H₇BrN₂. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 5-Amino-6-bromoquinoline are: (1)ACD/LogP: 2.12; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 2.05; (4)ACD/LogD (pH 7.4): 2.12; (5)ACD/BCF (pH 5.5): 20.447; (6)ACD/BCF (pH 7.4): 24.039; (7)ACD/KOC (pH 5.5): 288.086; (8)ACD/KOC (pH 7.4): 338.685; (9)#H bond acceptors: 2; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 38.91 Å²; (13)Index of Refraction: 1.732; (14)Molar Refractivity: 54.113 cm³; (15)Molar Volume: 135.238 cm³; (16)Polarizability: 21.452×10^-24cm³; (17)Surface Tension: 63.382 dyne/cm; (18)Enthalpy of Vaporization: 59.943 kJ/mol; (19)Vapour Pressure: 0 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: c1cc2c(ccc(c2N)Br)nc1
(2)InChI: InChI=1/C9H7BrN2/c10-7-3-4-8-6(9(7)11)2-1-5-12-8/h1-5H,11H2
(3)InChIKey: NTJCDJVVAOAONR-UHFFFAOYAM