Barium citrate
tris(barium(2+));bis(2-hydroxypropane-1,2,3-tricarboxylate)
Also Known As: BARIUM CITRATE|Tribarium dicitrate|Tribarium citrate|tribarium(2+) dicitrate|barium citrate monohydrate|Barium citrate heptahydrate|EINECS 208-140-6|EINECS 306-746-6|CITRIC ACID, BARIUM SALT (2:3)|BARIUM CITRATE (BA3(C6H5O7)2)|barium(2+);2-hydroxypropane-1,2,3-tricarboxylate|Citric acid barium salt heptahydrate [MI]|Barium citrate (Ba(O7C6H5)2), heptahydrate|Citric acid, barium salt (2:3), heptahydrate|Barium 2-hydroxypropane-1,2,3-tricarboxylate (3/2)|1,2,3-PROPANETRICARBOXYLIC ACID, 2-HYDROXY-, BARIUM SALT (2:3)|1,2,3-Propanetricarboxylicacid,2-hydroxy-,barium salt(1:3)|1,2,3-Propanetricarboxylicacid, 2-hydroxy-, barium salt (1:3)|1,2,3-Propanetricarboxylicacid, 2-hydroxy-, barium salt (2:3)|IUPAC: Barium(+2) Cation; 2-hydroxypropane-1,2,3-tricarboxylate|1,2,3-Propanetricarboxylic acid, 2-hydroxy-, barium salt (2:3), heptahydrate|1,2,3-Propanetricarboxylic acid, 2-hydroxy-, barium salt, hydrate (2:3:7)|208-140-6
| Molecular Formula | C12H10Ba3O14 |
|---|---|
| Molecular Weight | 791.7228 g/mol |
| LogP | -11.6476 |
| Topological Polar Surface Area | 281.24 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 14 |
| Rotatable Bonds | 10 |
| Exact Mass | 791.7228 |
| Monoisotopic Mass | 791.7228 |
| Heavy Atoms | 29 |
| Complexity | 520.6498 |
Chemical Identifiers
| CAS Number | 6487-29-2 |
|---|---|
| SMILES | C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.C(C(=O)[O-])C(CC(=O)[O-])(C(=O)[O-])O.[Ba+2].[Ba+2].[Ba+2] |
Product Overview
Barium citrate (CAS 6487-29-2), with molecular formula C12H10Ba3O14 and molecular weight 791.7228 g/mol. IUPAC: tris(barium(2+));bis(2-hydroxypropane-1,2,3-tricarboxylate).