lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate

C6H11LiO8 — CID 173006483

IUPAClithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
SMILESO.O=C(O)CC(O)(CC(=O)O)C(=O)O.[H-].[Li+]
InChIInChI=1S/C6H8O7.Li.H2O.H/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);;1H2;/q;+1;;-1
InChIKeyQYAOXCGPHABKBP-UHFFFAOYSA-N
MW218.09 g/mol
LogP-4.96
Rot. Bonds5

About lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate

lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate (PubChem CID 173006483) has the molecular formula C6H11LiO8 and a molecular weight of 218.09 g/mol. Its IUPAC name is lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate.

Molecular Properties

Compound Namelithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
PubChem CID173006483
Molecular FormulaC6H11LiO8
Molecular Weight218.09 g/mol
Exact Mass218.06
IUPAC Namelithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
SMILESO.O=C(O)CC(O)(CC(=O)O)C(=O)O.[H-].[Li+]
InChIInChI=1S/C6H8O7.Li.H2O.H/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);;1H2;/q;+1;;-1
InChIKeyQYAOXCGPHABKBP-UHFFFAOYSA-N
XLogP-4.96
TPSA163.63 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500218.09
LogP ≤ 5-4.96
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

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Related Compounds

lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;tetrahydrate
CID 173006490
lithium;potassium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
CID 173039774
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
potassium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;dihydrate
CID 173006482
magnesium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hexahydrate
CID 173498708
dicalcium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;tetrahydrate
CID 175537707
dipotassium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate
CID 174842577
hexapotassium;hydride;bis(2-hydroxypropane-1,2,3-tricarboxylic acid);tetrahydrate
CID 173194055
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
tris(2-hydroxypropane-1,2,3-tricarboxylic acid);dihydrate
CID 172729585

Frequently Asked Questions

What is the IUPAC name of lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate?
The IUPAC name of lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate (CID 173006483) is lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate.
What is the SMILES notation for lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate?
The canonical SMILES for lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate is O.O=C(O)CC(O)(CC(=O)O)C(=O)O.[H-].[Li+].
What is the InChIKey of lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate?
The InChIKey is QYAOXCGPHABKBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8O7.Li.H2O.H/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);;1H2;/q;+1;;-1.
What are the key properties of lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate?
lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate has a molecular weight of 218.09 g/mol, XLogP of -4.96, 5 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;hydride;2-hydroxypropane-1,2,3-tricarboxylic acid;hydrate is sourced from PubChem (CID 173006483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).