potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid

C4H11KNaO9P — CID 174791602

IUPACpotassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid
SMILESO=C(O)CC(O)C(=O)O.O=P(O)(O)O.[H-].[H-].[K+].[Na+]
InChIInChI=1S/C4H6O5.K.Na.H3O4P.2H/c5-2(4(8)9)1-3(6)7;;;1-5(2,3)4;;/h2,5H,1H2,(H,6,7)(H,8,9);;;(H3,1,2,3,4);;/q;2*+1;;2*-1
InChIKeyBFKLKFLCOBMJEQ-UHFFFAOYSA-N
MW296.19 g/mol
LogP-7.79
Rot. Bonds3

About potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid

potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid (PubChem CID 174791602) has the molecular formula C4H11KNaO9P and a molecular weight of 296.19 g/mol. Its IUPAC name is potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid.

Molecular Properties

Compound Namepotassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid
PubChem CID174791602
Molecular FormulaC4H11KNaO9P
Molecular Weight296.19 g/mol
Exact Mass295.97
IUPAC Namepotassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid
SMILESO=C(O)CC(O)C(=O)O.O=P(O)(O)O.[H-].[H-].[K+].[Na+]
InChIInChI=1S/C4H6O5.K.Na.H3O4P.2H/c5-2(4(8)9)1-3(6)7;;;1-5(2,3)4;;/h2,5H,1H2,(H,6,7)(H,8,9);;;(H3,1,2,3,4);;/q;2*+1;;2*-1
InChIKeyBFKLKFLCOBMJEQ-UHFFFAOYSA-N
XLogP-7.79
TPSA172.59 Ų
H-Bond Donors6
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.19
LogP ≤ 5-7.79
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Related Compounds

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2-hydroxybutanedioic acid;hydrate;hydrochloride
CID 172717640
azane;bismuthane;2-hydroxybutanedioic acid
CID 173447177
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CID 173385796
boric acid;bis(2-hydroxybutanedioic acid)
CID 175869930
2-aminoacetic acid;2-hydroxybutanedioic acid
CID 87750134
acetic acid;copper;2-hydroxybutanedioic acid
CID 175107089
(Z)-but-2-enedioic acid;2-hydroxybutanedioic acid
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ethanethioic S-acid;2-hydroxybutanedioic acid
CID 174988031

Frequently Asked Questions

What is the IUPAC name of potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid?
The IUPAC name of potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid (CID 174791602) is potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid.
What is the SMILES notation for potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid?
The canonical SMILES for potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid is O=C(O)CC(O)C(=O)O.O=P(O)(O)O.[H-].[H-].[K+].[Na+].
What is the InChIKey of potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid?
The InChIKey is BFKLKFLCOBMJEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H6O5.K.Na.H3O4P.2H/c5-2(4(8)9)1-3(6)7;;;1-5(2,3)4;;/h2,5H,1H2,(H,6,7)(H,8,9);;;(H3,1,2,3,4);;/q;2*+1;;2*-1.
What are the key properties of potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid?
potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid has a molecular weight of 296.19 g/mol, XLogP of -7.79, 3 rotatable bonds, 6 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;sodium;hydride;2-hydroxybutanedioic acid;phosphoric acid is sourced from PubChem (CID 174791602), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).