potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide

C3H6KNO5P+ — CID 140685921

IUPACpotassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide
SMILESO=[P+]([O-])O.[K+].[OH-].c1coc[nH+]1
InChIInChI=1S/C3H3NO.K.HO3P.H2O/c1-2-5-3-4-1;;1-4(2)3;/h1-3H;;(H,1,2,3);1H2/q;+1;;
InChIKeyFMWIMLGCZKWGBN-UHFFFAOYSA-N
MW206.16 g/mol
LogP-4.08
Rot. Bonds

About potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide

potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide (PubChem CID 140685921) has the molecular formula C3H6KNO5P+ and a molecular weight of 206.16 g/mol. Its IUPAC name is potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide.

Molecular Properties

Compound Namepotassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide
PubChem CID140685921
Molecular FormulaC3H6KNO5P+
Molecular Weight206.16 g/mol
Exact Mass205.96
IUPAC Namepotassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide
SMILESO=[P+]([O-])O.[K+].[OH-].c1coc[nH+]1
InChIInChI=1S/C3H3NO.K.HO3P.H2O/c1-2-5-3-4-1;;1-4(2)3;/h1-3H;;(H,1,2,3);1H2/q;+1;;
InChIKeyFMWIMLGCZKWGBN-UHFFFAOYSA-N
XLogP-4.08
TPSA117.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.16
LogP ≤ 5-4.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide?
The IUPAC name of potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide (CID 140685921) is potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide.
What is the SMILES notation for potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide?
The canonical SMILES for potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide is O=[P+]([O-])O.[K+].[OH-].c1coc[nH+]1.
What is the InChIKey of potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide?
The InChIKey is FMWIMLGCZKWGBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3NO.K.HO3P.H2O/c1-2-5-3-4-1;;1-4(2)3;/h1-3H;;(H,1,2,3);1H2/q;+1;;.
What are the key properties of potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide?
potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide has a molecular weight of 206.16 g/mol, XLogP of -4.08, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;1,3-oxazol-3-ium;phosphenic acid;hydroxide is sourced from PubChem (CID 140685921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).