1H-Pyrrolo[2,3-b]pyridine-5-carboxaldehyde (849067-90-9)

The 7-Azaindole-5-carboxaldehyde is an organic compound with the formula C₈H₅N₂O. The systematic name of this chemical is 1H-pyrrolo[2,3-b]pyridine-5-carbaldehyde. With the CAS registry number 849067-90-9, it is also named as 1H-Pyrrolo[2,3-b]pyridin-5-carbaldehyd.

Physical properties about 7-Azaindole-5-carboxaldehyde are: (1)ACD/LogP: 1.66; (2)ACD/LogD (pH 5.5): 1.66; (3)ACD/LogD (pH 7.4): 1.66; (4)ACD/BCF (pH 5.5): 10.76; (5)ACD/BCF (pH 7.4): 10.79; (6)ACD/KOC (pH 5.5): 190.45; (7)ACD/KOC (pH 7.4): 190.96; (8)#H bond acceptors: 3; (9)#H bond donors: 1; (10)#Freely Rotating Bonds: 1; (11)Polar Surface Area: 45.75 Å²; (12)Index of Refraction: 1.747; (13)Molar Refractivity: 43.37 cm³; (14)Molar Volume: 106.7 cm³; (15)Polarizability: 17.19×10^-24cm ³; (16)Surface Tension: 71 dyne/cm; (17)Density: 1.368 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: O=Cc1cc2ccnc2nc1
(2)InChI: InChI=1/C8H6N2O/c11-5-6-3-7-1-2-9-8(7)10-4-6/h1-5H,(H,9,10)
(3)InChIKey: HDANOCTXZFZIHB-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C8H6N2O/c11-5-6-3-7-1-2-9-8(7)10-4-6/h1-5H,(H,9,10)
(5)Std. InChIKey: HDANOCTXZFZIHB-UHFFFAOYSA-N