Magnesium aspartate hydrochloride trihydrateProduct ingredient for Magnesium aspartate hydrochloride
- Name
- Magnesium aspartate hydrochloride trihydrate
- Drug Entry
- Magnesium aspartate hydrochloride
- Accession Number
- DBSALT003157
- Structure
Structure for Magnesium aspartate hydrochloride trihydrate (DBSALT003157)
- Synonyms
- Magnesium L-aspartate hydrochloride trihydrate
- UNII
- B06NP3KG40
- CAS Number
- 91198-22-0
- Weight
- Average: 281.93
Monoisotopic: 281.0364005 - Chemical Formula
- C4H16ClMgNO9
- InChI Key
- BBRFANCCCAUJFS-PUAMRSTPSA-L
- InChI
- InChI=1S/C4H7NO4.ClH.Mg.3H2O/c5-2(4(8)9)1-3(6)7;;;;;/h2H,1,5H2,(H,6,7)(H,8,9);1H;;3*1H2/q;;+2;;;/p-2/t2-;;;;;/m0...../s1
- IUPAC Name
- magnesium(2+) (2S)-2-aminobutanedioate trihydrate hydrochloride
- SMILES
- O.O.O.[Mg++].Cl.N[C@@H](CC([O-])=O)C([O-])=O
- External Links
- ChemSpider
- 18615603
- Predicted Properties
Property Value Source logP -3.5 Chemaxon pKa (Strongest Acidic) 1.7 Chemaxon pKa (Strongest Basic) 9.61 Chemaxon Physiological Charge -1 Chemaxon Hydrogen Acceptor Count 5 Chemaxon Hydrogen Donor Count 1 Chemaxon Polar Surface Area 106.28 Å2 Chemaxon Rotatable Bond Count 3 Chemaxon Refractivity 48.21 m3·mol-1 Chemaxon Polarizability 10.56 Å3 Chemaxon Number of Rings 0 Chemaxon Bioavailability 1 Chemaxon Rule of Five Yes Chemaxon Ghose Filter No Chemaxon Veber's Rule No Chemaxon MDDR-like Rule No Chemaxon