dipotassium;dimethyl sulfate;carbonate

C3H6K2O7S — CID 158780158

IUPACdipotassium;dimethyl sulfate;carbonate
SMILESCOS(=O)(=O)OC.O=C([O-])[O-].[K+].[K+]
InChIInChI=1S/C2H6O4S.CH2O3.2K/c1-5-7(3,4)6-2;2-1(3)4;;/h1-2H3;(H2,2,3,4);;/q;;2*+1/p-2
InChIKeyIQYVPNQVJOUTPY-UHFFFAOYSA-L
MW264.34 g/mol
LogP-8.91
Rot. Bonds2

About dipotassium;dimethyl sulfate;carbonate

dipotassium;dimethyl sulfate;carbonate (PubChem CID 158780158) has the molecular formula C3H6K2O7S and a molecular weight of 264.34 g/mol. Its IUPAC name is dipotassium;dimethyl sulfate;carbonate.

Molecular Properties

Compound Namedipotassium;dimethyl sulfate;carbonate
PubChem CID158780158
Molecular FormulaC3H6K2O7S
Molecular Weight264.34 g/mol
Exact Mass263.91
IUPAC Namedipotassium;dimethyl sulfate;carbonate
SMILESCOS(=O)(=O)OC.O=C([O-])[O-].[K+].[K+]
InChIInChI=1S/C2H6O4S.CH2O3.2K/c1-5-7(3,4)6-2;2-1(3)4;;/h1-2H3;(H2,2,3,4);;/q;;2*+1/p-2
InChIKeyIQYVPNQVJOUTPY-UHFFFAOYSA-L
XLogP-8.91
TPSA115.79 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.34
LogP ≤ 5-8.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of dipotassium;dimethyl sulfate;carbonate?
The IUPAC name of dipotassium;dimethyl sulfate;carbonate (CID 158780158) is dipotassium;dimethyl sulfate;carbonate.
What is the SMILES notation for dipotassium;dimethyl sulfate;carbonate?
The canonical SMILES for dipotassium;dimethyl sulfate;carbonate is COS(=O)(=O)OC.O=C([O-])[O-].[K+].[K+].
What is the InChIKey of dipotassium;dimethyl sulfate;carbonate?
The InChIKey is IQYVPNQVJOUTPY-UHFFFAOYSA-L. The full InChI is InChI=1S/C2H6O4S.CH2O3.2K/c1-5-7(3,4)6-2;2-1(3)4;;/h1-2H3;(H2,2,3,4);;/q;;2*+1/p-2.
What are the key properties of dipotassium;dimethyl sulfate;carbonate?
dipotassium;dimethyl sulfate;carbonate has a molecular weight of 264.34 g/mol, XLogP of -8.91, 2 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;dimethyl sulfate;carbonate is sourced from PubChem (CID 158780158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).