potassium 2-methylpropan-2-olate

C4H9KO — CID 23665647

IUPACpotassium 2-methylpropan-2-olate
SMILESCC(C)(C)[O-].[K+]
InChIInChI=1S/C4H9O.K/c1-4(2,3)5;/h1-3H3;/q-1;+1
InChIKeyLPNYRYFBWFDTMA-UHFFFAOYSA-N
MW112.21 g/mol
LogP-2.85
Rot. Bonds

About potassium 2-methylpropan-2-olate

potassium 2-methylpropan-2-olate (PubChem CID 23665647) has the molecular formula C4H9KO and a molecular weight of 112.21 g/mol. Its IUPAC name is potassium 2-methylpropan-2-olate.

Molecular Properties

Compound Namepotassium 2-methylpropan-2-olate
PubChem CID23665647
Molecular FormulaC4H9KO
Molecular Weight112.21 g/mol
Exact Mass112.03
IUPAC Namepotassium 2-methylpropan-2-olate
SMILESCC(C)(C)[O-].[K+]
InChIInChI=1S/C4H9O.K/c1-4(2,3)5;/h1-3H3;/q-1;+1
InChIKeyLPNYRYFBWFDTMA-UHFFFAOYSA-N
XLogP-2.85
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.21
LogP ≤ 5-2.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of potassium 2-methylpropan-2-olate?
The IUPAC name of potassium 2-methylpropan-2-olate (CID 23665647) is potassium 2-methylpropan-2-olate.
What is the SMILES notation for potassium 2-methylpropan-2-olate?
The canonical SMILES for potassium 2-methylpropan-2-olate is CC(C)(C)[O-].[K+].
What is the InChIKey of potassium 2-methylpropan-2-olate?
The InChIKey is LPNYRYFBWFDTMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9O.K/c1-4(2,3)5;/h1-3H3;/q-1;+1.
What are the key properties of potassium 2-methylpropan-2-olate?
potassium 2-methylpropan-2-olate has a molecular weight of 112.21 g/mol, XLogP of -2.85, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 2-methylpropan-2-olate is sourced from PubChem (CID 23665647), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).