The Sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate, with the CAS registry number 94441-92-6, is also known as beta-Alanine, N-(2-carboxyethyl)-N-(2-ethylhexyl)-,monosodium salt.It belongs to the product categories of Pharmaceuticals.Its EINECS number is 305-318-6. What's more,Its systematic name is Sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate.Physical properties about Sodium N-(2-carboxyethyl)-N-(2-ethylhexyl)-beta-alaninate are:(1)#h bond acceptors: 5; (2)#h bond donors: 2; (3)#freely rotating bonds: 12.
You can still convert the following datas into molecular structure:
(1)SMILES:[Na+].OC(=O)CCN(CC(CCCC)CC)CCC([O-])=O;
(2)Std. InChI:InChI=1S/C14H27NO4.Na/c1-3-5-6-12(4-2)11-15(9-7-13(16)17)10-8-14(18)19;/h12H,3-11H2,1-2H3,(H,16,17)(H,18,19);/q;+1/p-1;
(3)Std. InChIKey:WVQFKDGIJVWORA-UHFFFAOYSA-M.
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