3-Chloro-5H-pyrrolo[2,3-b]pyrazine (1111638-10-8)

The 3-Chloro-5H-pyrrolo[2,3-b]pyrazine is an organic compound with the formula C₆H₄ClN₃. The systematic name of this chemical is 2-chloro-5H-pyrrolo[2,3-b]pyrazine. With the CAS registry number 1111638-10-8, it is also named as 5H-pyrrolo[2,3-b]pyrazine, 2-chloro-.

Physical properties about 3-Chloro-5H-pyrrolo[2,3-b]pyrazine are: (1)ACD/LogP: 2.16; (2)ACD/LogD (pH 5.5): 2.16; (3)ACD/LogD (pH 7.4): 2.16  ; (4)#H bond acceptors: 3; (5)#H bond donors: 1; (6)Polar Surface Area: 41.57 Å²; (7)Index of Refraction: 1.72; (8)Molar Refractivity: 39.6 cm³; (9)Molar Volume: 100.2 cm³; (10)Polarizability: 15.7×10^-24cm³; (11)Surface Tension: 74.7 dyne/cm; (12)Density: 1.531 g/cm³.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c[nH]c2c1nc(cn2)Cl
(2)InChI: InChI=1/C6H4ClN3/c7-5-3-9-6-4(10-5)1-2-8-6/h1-3H,(H,8,9)
(3)InChIKey: RORAIVYFQFAIAF-UHFFFAOYAX
(4)Std. InChI: InChI=1S/C6H4ClN3/c7-5-3-9-6-4(10-5)1-2-8-6/h1-3H,(H,8,9)
(5)Std. InChIKey: RORAIVYFQFAIAF-UHFFFAOYSA-N