dipotassium;2-hydroxy-2-oxoacetate;nitrite

C2HK2NO6 — CID 176892574

IUPACdipotassium;2-hydroxy-2-oxoacetate;nitrite
SMILESO=C([O-])C(=O)O.O=N[O-].[K+].[K+]
InChIInChI=1S/C2H2O4.2K.HNO2/c3-1(4)2(5)6;;;2-1-3/h(H,3,4)(H,5,6);;;(H,2,3)/q;2*+1;/p-2
InChIKeyGAHPICDGSHVOGS-UHFFFAOYSA-L
MW213.23 g/mol
LogP-7.92
Rot. Bonds

About dipotassium;2-hydroxy-2-oxoacetate;nitrite

dipotassium;2-hydroxy-2-oxoacetate;nitrite (PubChem CID 176892574) has the molecular formula C2HK2NO6 and a molecular weight of 213.23 g/mol. Its IUPAC name is dipotassium;2-hydroxy-2-oxoacetate;nitrite.

Molecular Properties

Compound Namedipotassium;2-hydroxy-2-oxoacetate;nitrite
PubChem CID176892574
Molecular FormulaC2HK2NO6
Molecular Weight213.23 g/mol
Exact Mass212.91
IUPAC Namedipotassium;2-hydroxy-2-oxoacetate;nitrite
SMILESO=C([O-])C(=O)O.O=N[O-].[K+].[K+]
InChIInChI=1S/C2H2O4.2K.HNO2/c3-1(4)2(5)6;;;2-1-3/h(H,3,4)(H,5,6);;;(H,2,3)/q;2*+1;/p-2
InChIKeyGAHPICDGSHVOGS-UHFFFAOYSA-L
XLogP-7.92
TPSA129.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.23
LogP ≤ 5-7.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'N_oxide', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

hydron;2-hydroxy-2-oxoacetate
CID 173323775
carbanide;oxalic acid;platinum;nitrite
CID 58115577
sodium;2-hydroxy-2-oxoacetate;hydrochloride
CID 141113765
azane;hydron;2-hydroxy-2-oxoacetate
CID 173005395
bis(2-hydroxy-2-oxoacetate);oxotitanium
CID 50910318
lithium;2-hydroxy-2-oxoacetate;oxalic acid
CID 158730065
dipotassium;chloride;nitrite
CID 161253797
dipotassium;(Z)-1,4-dihydroxy-1,4-dioxobut-2-ene-2,3-diolate
CID 159492381
dicesium;oxalate;oxalic acid
CID 139047243
sodium;2-hydroxy-2-oxoacetate;phosphoric acid
CID 159452924
decapotassium;carbonic acid;pentacarbonate
CID 173334932
icosapotassium;carbonic acid;hydrogen carbonate
CID 173305158

Frequently Asked Questions

What is the IUPAC name of dipotassium;2-hydroxy-2-oxoacetate;nitrite?
The IUPAC name of dipotassium;2-hydroxy-2-oxoacetate;nitrite (CID 176892574) is dipotassium;2-hydroxy-2-oxoacetate;nitrite.
What is the SMILES notation for dipotassium;2-hydroxy-2-oxoacetate;nitrite?
The canonical SMILES for dipotassium;2-hydroxy-2-oxoacetate;nitrite is O=C([O-])C(=O)O.O=N[O-].[K+].[K+].
What is the InChIKey of dipotassium;2-hydroxy-2-oxoacetate;nitrite?
The InChIKey is GAHPICDGSHVOGS-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H2O4.2K.HNO2/c3-1(4)2(5)6;;;2-1-3/h(H,3,4)(H,5,6);;;(H,2,3)/q;2*+1;/p-2.
What are the key properties of dipotassium;2-hydroxy-2-oxoacetate;nitrite?
dipotassium;2-hydroxy-2-oxoacetate;nitrite has a molecular weight of 213.23 g/mol, XLogP of -7.92, 0 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;2-hydroxy-2-oxoacetate;nitrite is sourced from PubChem (CID 176892574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).