magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate

C6H22MgO13 — CID 173498708

IUPACmagnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate
SMILESO.O.O.O.O.O.O=C(O)CC(O)(CC(=O)O)C(=O)O.[H-].[H-].[Mg+2]
InChIInChI=1S/C6H8O7.Mg.6H2O.2H/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;6*1H2;;/q;+2;;;;;;;2*-1
InChIKeyGGCUUEONAQTJIM-UHFFFAOYSA-N
MW326.53 g/mol
LogP-6.35
Rot. Bonds5

About magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate

magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate (PubChem CID 173498708) has the molecular formula C6H22MgO13 and a molecular weight of 326.53 g/mol. Its IUPAC name is magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate.

Molecular Properties

Compound Namemagnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate
PubChem CID173498708
Molecular FormulaC6H22MgO13
Molecular Weight326.53 g/mol
Exact Mass326.09
IUPAC Namemagnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate
SMILESO.O.O.O.O.O.O=C(O)CC(O)(CC(=O)O)C(=O)O.[H-].[H-].[Mg+2]
InChIInChI=1S/C6H8O7.Mg.6H2O.2H/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;6*1H2;;/q;+2;;;;;;;2*-1
InChIKeyGGCUUEONAQTJIM-UHFFFAOYSA-N
XLogP-6.35
TPSA321.13 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.53
LogP ≤ 5-6.35
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

trimagnesium;hydride;bis(2-hydroxypropane-1,2,3-tricarboxylic acid);hydrate
CID 173246705
barium(2+);hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;heptahydrate
CID 173410096
trimagnesium;carbonic acid;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid
CID 173041286
lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
CID 173006483
potassium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;dihydrate
CID 173006482
lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;tetrahydrate
CID 173006490
sodium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;heptahydrate
CID 173006501
trisodium;hydride;bis(2-hydroxypropane-1,2,3-tricarboxylic acid);dihydrate
CID 173025138
dipotassium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
CID 174842577
dicalcium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;tetrahydrate
CID 175537707
hexapotassium;hydride;bis(2-hydroxypropane-1,2,3-tricarboxylic acid);tetrahydrate
CID 173194055
hydrogen peroxide;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
CID 158473512

Frequently Asked Questions

What is the IUPAC name of magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate?
The IUPAC name of magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate (CID 173498708) is magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate.
What is the SMILES notation for magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate?
The canonical SMILES for magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate is O.O.O.O.O.O.O=C(O)CC(O)(CC(=O)O)C(=O)O.[H-].[H-].[Mg+2].
What is the InChIKey of magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate?
The InChIKey is GGCUUEONAQTJIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O7.Mg.6H2O.2H/c7-3(8)1-6(13,5(11)12)2-4(9)10;;;;;;;;;/h13H,1-2H2,(H,7,8)(H,9,10)(H,11,12);;6*1H2;;/q;+2;;;;;;;2*-1.
What are the key properties of magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate?
magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate has a molecular weight of 326.53 g/mol, XLogP of -6.35, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate is sourced from PubChem (CID 173498708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).