3-Pyridinesulfonicacid, 6-methyl- (4808-69-9)

The 6-Methylpyridine-3-sulfonic acid with the CAS number 4808-69-9 is also called 3-Pyridinesulfonicacid, 6-methyl-. Its molecular formula is C₆H₇NO₃S. This chemical is a kind of organics. It should be stored in dry and cool environment.

The properties of the chemical are: (1)ACD/LogP: -0.56; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -3.71; (4)ACD/LogD (pH 7.4): -4.05; (5)ACD/BCF (pH 5.5): 1; (6)ACD/BCF (pH 7.4): 1; (7)ACD/KOC (pH 5.5): 1; (8)ACD/KOC (pH 7.4): 1; (9)#H bond acceptors: 4; (10)#H bond donors: 1; (11)#Freely Rotating Bonds: 1; (12)Polar Surface Area: 64.64 Å²; (13)Index of Refraction: 1.562; (14)Molar Refractivity: 39.52 cm³; (15)Molar Volume: 121.7 cm³; (16)Polarizability: 15.66×10^-24cm³; (17)Surface Tension: 56.7 dyne/cm.

You can still convert the following datas into molecular structure:
(1)SMILES: O=S(=O)(O)c1cnc(cc1)C
(2)InChI: InChI=1/C6H7NO3S/c1-5-2-3-6(4-7-5)11(8,9)10/h2-4H,1H3,(H,8,9,10)
(3)InChIKey: QFPGRDDFLCHSMR-UHFFFAOYAA