potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate

C4H4KNaO6 — CID 9357

IUPACpotassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate
SMILESO=C([O-])[C@H](O)[C@@H](O)C(=O)[O-].[K+].[Na+]
InChIInChI=1S/C4H6O6.K.Na/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-;;/m1../s1
InChIKeyLJCNRYVRMXRIQR-OLXYHTOASA-L
MW210.16 g/mol
LogP-10.78
Rot. Bonds3

About potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate

potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate (PubChem CID 9357) has the molecular formula C4H4KNaO6 and a molecular weight of 210.16 g/mol. Its IUPAC name is potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate.

Molecular Properties

Compound Namepotassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate
PubChem CID9357
Molecular FormulaC4H4KNaO6
Molecular Weight210.16 g/mol
Exact Mass209.95
IUPAC Namepotassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate
SMILESO=C([O-])[C@H](O)[C@@H](O)C(=O)[O-].[K+].[Na+]
InChIInChI=1S/C4H6O6.K.Na/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-;;/m1../s1
InChIKeyLJCNRYVRMXRIQR-OLXYHTOASA-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 ≤ 500210.16
LogP ≤ 5-10.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate?
The IUPAC name of potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate (CID 9357) is potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate.
What is the SMILES notation for potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate?
The canonical SMILES for potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate is O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-].[K+].[Na+].
What is the InChIKey of potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate?
The InChIKey is LJCNRYVRMXRIQR-OLXYHTOASA-L. The full InChI is InChI=1S/C4H6O6.K.Na/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-;;/m1../s1.
What are the key properties of potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate?
potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate has a molecular weight of 210.16 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 potassium;sodium;(2R,3R)-2,3-dihydroxybutanedioate is sourced from PubChem (CID 9357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).