Calcium bis(1,3,4,5-tetrahydroxycyclohexanecarboxylate)
calcium bis(1,3,4,5-tetrahydroxycyclohexane-1-carboxylate)
Also Known As: calciumbis|EINECS 227-333-6|C7H12O6.1/2Ca|C7-H12-O6.1/2Ca|Calcium bis(1,3,4,5-tetrahydroxycyclohexanecarboxylate)|calcium 1,3,4,5-tetrahydroxycyclohexane-1-carboxylate|calcium,1,3,4,5-tetrahydroxycyclohexane-1-carboxylate|CALCIUM BIS(1,3,4,5-TETRAHYDROXYCYCLOHEXANE-1-CARBOXYLATE)|Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, calcium salt (2:1)|Cyclohexanecarboxylic acid, 1,3,4,5-tetrahydroxy-, calcium salt (2:1), (1.alpha.,3.alpha.,4.alpha.,5.beta.)-|Cyclohexanecarboxylicacid, 1,3,4,5-tetrahydroxy-, calcium salt (2:1), (1a,3a,4a,5b)- (9CI)
| Molecular Formula | C14H22CaO12 |
|---|---|
| Molecular Weight | 422.07373 g/mol |
| LogP | -7.69 |
| Topological Polar Surface Area | 242.1 Ų |
| Hydrogen Bond Donors | 8 |
| Hydrogen Bond Acceptors | 12 |
| Rotatable Bonds | 2 |
| Exact Mass | 422.07373 |
| Heavy Atoms | 27 |
| Complexity | 458.2 |
Chemical Identifiers
| CAS Number | 5793-87-3 |
|---|---|
| SMILES | C1C(C(C(CC1(C(=O)[O-])O)O)O)O.C1C(C(C(CC1(C(=O)[O-])O)O)O)O.[Ca+2] |
Product Overview
Calcium bis(1,3,4,5-tetrahydroxycyclohexanecarboxylate) (CAS 5793-87-3), with molecular formula C14H22CaO12 and molecular weight 422.07373 g/mol. IUPAC: calcium bis(1,3,4,5-tetrahydroxycyclohexane-1-carboxylate).
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