5H-Pyrrolo[3,4-b]pyridine,2-chloro-6,7-dihydro- (810668-57-6)

The 2-Chloro-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine with the CAS number 810668-57-6 is also called 5H-Pyrrolo[3,4-b]pyridine,2-chloro-6,7-dihydro-. Its molecular formula is C₇H₇ClN₂. The product category is Chiral Chemicals. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the 2-Chloro-6,7-dihydro-5H-pyrrolo[3,4-b]pyridine are: (1)ACD/LogP: 0.19; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): 0.02; (4)ACD/LogD (pH 7.4): 0.18; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 20.31; (8)ACD/KOC (pH 7.4): 29.86; (9)#H bond acceptors: 2; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 0; (12)Polar Surface Area: 16.13Ų; (13)Index of Refraction: 1.585; (14)Molar Refractivity: 40.14 cm³; (15)Molar Volume: 119.7 cm³; (16)Polarizability: 15.91×10^-24cm³; (17)Surface Tension: 48.6 dyne/cm; (18)Enthalpy of Vaporization: 49.3 kJ/mol; (19)Vapour Pressure: 0.0162 mmHg at 25°C.

You can still convert the following datas into molecular structure:
(1)SMILES: Clc1nc2c(cc1)CNC2
(2)InChI: InChI=1/C7H7ClN2/c8-7-2-1-5-3-9-4-6(5)10-7/h1-2,9H,3-4H2
(3)InChIKey: MSLXPRCFQNRAPN-UHFFFAOYAO