potassium methanediol

CH4KO2+ — CID 22156370

IUPACpotassium methanediol
SMILESOCO.[K+]
InChIInChI=1S/CH4O2.K/c2-1-3;/h2-3H,1H2;/q;+1
InChIKeyKPQONIUOIUOOMC-UHFFFAOYSA-N
MW87.14 g/mol
LogP-4.07
Rot. Bonds

About potassium methanediol

potassium methanediol (PubChem CID 22156370) has the molecular formula CH4KO2+ and a molecular weight of 87.14 g/mol. Its IUPAC name is potassium methanediol.

Molecular Properties

Compound Namepotassium methanediol
PubChem CID22156370
Molecular FormulaCH4KO2+
Molecular Weight87.14 g/mol
Exact Mass86.98
IUPAC Namepotassium methanediol
SMILESOCO.[K+]
InChIInChI=1S/CH4O2.K/c2-1-3;/h2-3H,1H2;/q;+1
InChIKeyKPQONIUOIUOOMC-UHFFFAOYSA-N
XLogP-4.07
TPSA40.46 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50087.14
LogP ≤ 5-4.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Related Compounds

methanediol;tungsten
CID 58612637
methanamine;tris(methanediol)
CID 173091621
potassium hydroxymethanolate
CID 57421782
dipotassium bis(2-hydroxyacetate)
CID 140653272
potassium 3-hydroxy-2-oxopropanoate
CID 117064470
potassium;boranuide;ethanol
CID 174924837
hydrazine;hydroxymethylphosphanium;chloride
CID 172822599
sodium;3-hydroxy-2-oxopropanoate;hydrate
CID 117064447
potassium;hydride;propane-1,3-diol
CID 173407766
methanediol;pentane-1,5-diol
CID 90027781
dipotassium;ethanol;chloride;hydroxide;hydrate
CID 175552778
tetrakis(2-hydroxyacetic acid);silane
CID 173225780

Frequently Asked Questions

What is the IUPAC name of potassium methanediol?
The IUPAC name of potassium methanediol (CID 22156370) is potassium methanediol.
What is the SMILES notation for potassium methanediol?
The canonical SMILES for potassium methanediol is OCO.[K+].
What is the InChIKey of potassium methanediol?
The InChIKey is KPQONIUOIUOOMC-UHFFFAOYSA-N. The full InChI is InChI=1S/CH4O2.K/c2-1-3;/h2-3H,1H2;/q;+1.
What are the key properties of potassium methanediol?
potassium methanediol has a molecular weight of 87.14 g/mol, XLogP of -4.07, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium methanediol is sourced from PubChem (CID 22156370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).