1-Naphthalenesulfonicacid, 8-(phenylamino)-, magnesium salt (2:1) (18108-68-4)

The 8-Anilino-1-naphthalenesulfonic acid magnesium salt, with the CAS registry number 18108-68-4 and EINECS registry number 242-004-7, has the systematic name of magnesium bis[8-(phenylamino)naphthalene-1-sulfonate. The molecular formula of the chemical is 2(C₁₆H₁₂NO₃S)^.Mg. And it belongs to the following product categories: Mg (Magnesium) Compounds; Classes of Metal Compounds; Typical Metal Compounds.

The characteristics of this chemical are as followings: (1)ACD/LogP: 2.45; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -1.04; (4)ACD/LogD (pH 7.4): -1.05; (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: 2; (11)#Freely Rotating Bonds: 3.

You should be cautious while dealing with this chemical. It irritates to eyes, respiratory system and skin. Therefore, you had better take the following instructions: Wear suitable protective gloves and eye/face protection, and if in case of contacting with eyes, rinse immediately with plenty of water and seek medical advice.

Addtionally, the following datas could be converted into the molecular structure:
(1)SMILES: [Mg+2].[O-]S(=O)(=O)c1c2c(ccc1)cccc2Nc3ccccc3.[O-]S(=O)(=O)c2c1c(cccc1ccc2)Nc3ccccc3
(2)InChI: InChI=1/2C16H13NO3S.Mg/c2*18-21(19,20)15-11-5-7-12-6-4-10-14(16(12)15)17-13-8-2-1-3-9-13;/h2*1-11,17H,(H,18,19,20);/q;;+2/p-2
(3)InChIKey: IRKGXNAZPUOEMW-NUQVWONBAY