potassium;2-methylpropan-2-olate;methylsulfinylmethane

C6H15KO2S — CID 87549036

IUPACpotassium;2-methylpropan-2-olate;methylsulfinylmethane
SMILESCC(C)(C)[O-].CS(C)=O.[K+]
InChIInChI=1S/C4H9O.C2H6OS.K/c1-4(2,3)5;1-4(2)3;/h1-3H3;1-2H3;/q-1;;+1
InChIKeyDAPIMSMZSXHIOD-UHFFFAOYSA-N
MW190.35 g/mol
LogP-2.86
Rot. Bonds

About potassium;2-methylpropan-2-olate;methylsulfinylmethane

potassium;2-methylpropan-2-olate;methylsulfinylmethane (PubChem CID 87549036) has the molecular formula C6H15KO2S and a molecular weight of 190.35 g/mol. Its IUPAC name is potassium;2-methylpropan-2-olate;methylsulfinylmethane.

Molecular Properties

Compound Namepotassium;2-methylpropan-2-olate;methylsulfinylmethane
PubChem CID87549036
Molecular FormulaC6H15KO2S
Molecular Weight190.35 g/mol
Exact Mass190.04
IUPAC Namepotassium;2-methylpropan-2-olate;methylsulfinylmethane
SMILESCC(C)(C)[O-].CS(C)=O.[K+]
InChIInChI=1S/C4H9O.C2H6OS.K/c1-4(2,3)5;1-4(2)3;/h1-3H3;1-2H3;/q-1;;+1
InChIKeyDAPIMSMZSXHIOD-UHFFFAOYSA-N
XLogP-2.86
TPSA40.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.35
LogP ≤ 5-2.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of potassium;2-methylpropan-2-olate;methylsulfinylmethane?
The IUPAC name of potassium;2-methylpropan-2-olate;methylsulfinylmethane (CID 87549036) is potassium;2-methylpropan-2-olate;methylsulfinylmethane.
What is the SMILES notation for potassium;2-methylpropan-2-olate;methylsulfinylmethane?
The canonical SMILES for potassium;2-methylpropan-2-olate;methylsulfinylmethane is CC(C)(C)[O-].CS(C)=O.[K+].
What is the InChIKey of potassium;2-methylpropan-2-olate;methylsulfinylmethane?
The InChIKey is DAPIMSMZSXHIOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H9O.C2H6OS.K/c1-4(2,3)5;1-4(2)3;/h1-3H3;1-2H3;/q-1;;+1.
What are the key properties of potassium;2-methylpropan-2-olate;methylsulfinylmethane?
potassium;2-methylpropan-2-olate;methylsulfinylmethane has a molecular weight of 190.35 g/mol, XLogP of -2.86, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for potassium;2-methylpropan-2-olate;methylsulfinylmethane is sourced from PubChem (CID 87549036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).