Basic Information | Post buying leads | Suppliers |
Name |
Butanedioic acid,2-sulfo-, sodium salt (1:3) |
EINECS | 236-524-3 |
CAS No. | 13419-59-5 | Density | N/A |
PSA | 145.84000 | LogP | -3.12910 |
Solubility | N/A | Melting Point |
N/A |
Formula | C4H3Na3O7S | Boiling Point | N/A |
Molecular Weight | 264.09673 | Flash Point | N/A |
Transport Information | N/A | Appearance | N/A |
Safety | Risk Codes | N/A | |
Molecular Structure | Hazard Symbols | N/A | |
Synonyms |
Butanedioicacid, sulfo-, trisodium salt (9CI);Succinic acid, sulfo-, trisodium salt(6CI,8CI);Sulfosuccinic acid trisodium salt;Trisodium sulfosuccinate; |
The Butanedioic acid,2-sulfo-, sodium salt (1:3), with the CAS registry number 13419-59-5, is also known as Trisodium sulfosuccinate. Its molecular formula is C4H3Na3O7S and its molecular weight is 264.09673. Additionally, its IUPAC name is trisodium 2-sulfonatobutanedioate.
Other characteristics of the Butanedioic acid,2-sulfo-, sodium salt (1:3) can be summarised as followings: (1)ACD/LogP: -1.90; (2)# of Rule of 5 Violations: 0; (3)ACD/LogD (pH 5.5): -6.96; (4)ACD/LogD (pH 7.4): -7.62; (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: 7; (10)#H bond donors: 3; (11)#Freely Rotating Bonds: 4; (12)Polar Surface Area: 137.35 Å2.
You can still convert the following datas into molecular structure:
1.SMILES: [Na+].[Na+].[Na+].[O-]S(=O)(=O)C(C(=O)[O-])CC([O-])=O
2.InChI: InChI=1/C4H6O7S.3Na/c5-3(6)1-2(4(7)8)12(9,10)11;;;/h2H,1H2,(H,5,6)(H,7,8)(H,9,10,11);;;/q;3*+1/p-3
3.InChIKey: ZXGOACRTCPRVON-DFZHHIFOAT