5H-Pyrrolo[2,3-b]pyrazine-6-carboxylicacid, 2-fluoro- (1016241-84-1)

The 2-Fluoro-5H-pyrrolo[2,3-b]pyrazine-6-carboxylic acid with the CAS number 1016241-84-1 is also called 5H-Pyrrolo[2,3-b]pyrazine-6-carboxylicacid, 2-fluoro-. Its molecular formula is C₇H₄FN₃O₂. 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 chemical are: (1)# of Rule of 5 Violations: 0; (2)ACD/BCF (pH 5.5): 1; (3)ACD/BCF (pH 7.4): 1; (4)ACD/KOC (pH 5.5): 1; (5)ACD/KOC (pH 7.4): 1; (6)#H bond acceptors: 5; (7)#H bond donors: 2; (8)#Freely Rotating Bonds: 1; (9)Polar Surface Area: 78.87 Å²; (10)Index of Refraction: 1.723; (11)Molar Refractivity: 41.635 cm³; (12)Molar Volume: 105.058 cm³; (13)Polarizability: 16.505×10^-24cm³; (14)Surface Tension: 95.311 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: c1c2c([nH]c1C(=O)O)ncc(n2)F
(2)InChI: InChI=1/C7H4FN3O2/c8-5-2-9-6-3(10-5)1-4(11-6)7(12)13/h1-2H,(H,9,11)(H,12,13)
(3)InChIKey: KNVLQSINHMBKCE-UHFFFAOYAP