Almagel-neo
Basic information
- CAS
8065-58-5- Standard SMILES
OC[C@@H](O)[C@@H](O)[C@H](O)[C@@H](O)CO.[Al+3].[Mg+2].[O-2].[O-2].[O-2].[OH-]- InChIKey
LXQWYAUAMDGFHH-VMIFZFQBSA-K- Molecular formula
- C6H15AlMgO10-2
- Average molar mass
- 298.46 g/mol
- Monoisotopic mass
- 298.0331018
Names & identifiers
- Preferred name
- Almagel-neo
- IUPAC
- aluminum;magnesium;(2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol;tris(oxygen(2-));hydroxide
- English name
- Almagel-neo
- Molecular formula
- C6H18AlMgO10
- Molecular weight
- 301.49
Names & synonyms
Almagel laxansAlmagel-neo8065-58-5RefChem:915430aluminum;magnesium;(2R,3R,4R,5S)-hexane-1,2,3,4,5,6-hexol;oxygen(2-);hydroxideD-Glucitol, mixt. with aluminum hydroxide and magnesium oxide
Database identifiers
- CAS
8065-58-5- PubChem CID
- 165698
Properties
Computed structural properties
- Topological polar surface area
- 125 Ų
- Hydrogen bond donors
- 7
- Hydrogen bond acceptors
- 10
- Rotatable bonds
- 5
- Heavy atoms
- 18
- Formal charge
- -2
- Complexity
- 105
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…