1-Propanesulfonic acid,2-methyl-2-[(1-oxo-2-propen-1-yl)amino]-, sodium salt (1:1) (5165-97-9)

The 2-Acrylamido-2-methyl-1-propanesulfonic acid sodium salt with the CAS number 5165-97-9 is also called 1-Propanesulfonic acid,2-methyl-2-[(1-oxo-2-propen-1-yl)amino]-, sodium salt (1:1). The systematic name is sodium 2-(acryloylamino)-2-methylpropane-1-sulfonate. Its molecular formula is C₇H₁₂NNaO₄S. The EINECS registry number is 225-948-4. This chemical belongs to the following product categories: (1)Acrylamide and Methacrylamide; (2)Acrylic Monomers; (3)Monomers.

The properties of the chemical are: (1)ACD/LogP: -1.79; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -5.16; (4)ACD/LogD (pH 7.4): -5.28; (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: 5; (10)#H bond donors: 2; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 83.06 Å².

While using this chemical, you should be very cautious. This chemical is not only irritating to skin, but also irritating to eyes and respiratory system. Therefore, you should take the following instructions. Firstly, you should wear suitable protective clothing, gloves and eye/face protection. Then in case of contact with eyes, you should rinse immediately with plenty of water and seek medical advice.

You can still convert the following datas into molecular structure:
(1)SMILES: [Na+].[O-]S(=O)(=O)CC(NC(=O)\C=C)(C)C
(2)InChI: InChI=1/C7H13NO4S.Na/c1-4-6(9)8-7(2,3)5-13(10,11)12;/h4H,1,5H2,2-3H3,(H,8,9)(H,10,11,12);/q;+1/p-1
(3)InChIKey: FWFUWXVFYKCSQA-REWHXWOFAM