dipotassium;(2R,3S)-2,3-dihydroxybutanedioate

C4H4K2O6 — CID 6452017

IUPACdipotassium;(2R,3S)-2,3-dihydroxybutanedioate
SMILESO=C([O-])[C@@H](O)[C@@H](O)C(=O)[O-].[K+].[K+]
InChIInChI=1S/C4H6O6.2K/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);;/q;2*+1/p-2/t1-,2+;;
InChIKeyAVTYONGGKAJVTE-BZMHZNRSSA-L
MW226.27 g/mol
LogP-10.78
Rot. Bonds3

About dipotassium;(2R,3S)-2,3-dihydroxybutanedioate

dipotassium;(2R,3S)-2,3-dihydroxybutanedioate (PubChem CID 6452017) has the molecular formula C4H4K2O6 and a molecular weight of 226.27 g/mol. Its IUPAC name is dipotassium;(2R,3S)-2,3-dihydroxybutanedioate.

Molecular Properties

Compound Namedipotassium;(2R,3S)-2,3-dihydroxybutanedioate
PubChem CID6452017
Molecular FormulaC4H4K2O6
Molecular Weight226.27 g/mol
Exact Mass225.93
IUPAC Namedipotassium;(2R,3S)-2,3-dihydroxybutanedioate
SMILESO=C([O-])[C@@H](O)[C@@H](O)C(=O)[O-].[K+].[K+]
InChIInChI=1S/C4H6O6.2K/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);;/q;2*+1/p-2/t1-,2+;;
InChIKeyAVTYONGGKAJVTE-BZMHZNRSSA-L
XLogP-10.78
TPSA120.72 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.27
LogP ≤ 5-10.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

potassium;2,3-dihydroxybutanedioate;zirconium(2+)
CID 19373860
potassium;antimony(3+);bis((2R,3R)-2,3-dihydroxybutanedioate)
CID 90471392
2,3-dihydroxybutanedioate
CID 19608871
tetraaluminum;tris(2,3-dihydroxybutanedioate);oxalate
CID 21451236
dibismuth;tris((2R,3R)-2,3-dihydroxybutanedioate)
CID 3080629
2,3-dihydroxybutanedioate;manganese(2+)
CID 22027285
azanium;potassium;sodium;2,3-dihydroxybutanedioate;chloride
CID 160595070
dibismuth;tris(2,3-dihydroxybutanedioate);hexahydrate
CID 173203823
copper;2,3-dihydroxybutanedioate;tetrahydrate
CID 159915205
azanium;2,3-dihydroxybutanedioate;iron(3+)
CID 22027283
dicalcium;bis(2,3-dihydroxybutanedioate);tetrahydrate
CID 159194146
azanium;cerium(3+);2,3-dihydroxybutanedioate;(2R,3R)-2,3-dihydroxybutanedioate
CID 90475534

Frequently Asked Questions

What is the IUPAC name of dipotassium;(2R,3S)-2,3-dihydroxybutanedioate?
The IUPAC name of dipotassium;(2R,3S)-2,3-dihydroxybutanedioate (CID 6452017) is dipotassium;(2R,3S)-2,3-dihydroxybutanedioate.
What is the SMILES notation for dipotassium;(2R,3S)-2,3-dihydroxybutanedioate?
The canonical SMILES for dipotassium;(2R,3S)-2,3-dihydroxybutanedioate is O=C([O-])[C@@H](O)[C@@H](O)C(=O)[O-].[K+].[K+].
What is the InChIKey of dipotassium;(2R,3S)-2,3-dihydroxybutanedioate?
The InChIKey is AVTYONGGKAJVTE-BZMHZNRSSA-L. The full InChI is InChI=1S/C4H6O6.2K/c5-1(3(7)8)2(6)4(9)10;;/h1-2,5-6H,(H,7,8)(H,9,10);;/q;2*+1/p-2/t1-,2+;;.
What are the key properties of dipotassium;(2R,3S)-2,3-dihydroxybutanedioate?
dipotassium;(2R,3S)-2,3-dihydroxybutanedioate has a molecular weight of 226.27 g/mol, XLogP of -10.78, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;(2R,3S)-2,3-dihydroxybutanedioate is sourced from PubChem (CID 6452017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).