dipotassium;1,1-dimethoxyethane;carbonate

C5H10K2O5 — CID 174946253

IUPACdipotassium;1,1-dimethoxyethane;carbonate
SMILESCOC(C)OC.O=C([O-])[O-].[K+].[K+]
InChIInChI=1S/C4H10O2.CH2O3.2K/c1-4(5-2)6-3;2-1(3)4;;/h4H,1-3H3;(H2,2,3,4);;/q;;2*+1/p-2
InChIKeyOXMCPBROHQFLNY-UHFFFAOYSA-L
MW228.33 g/mol
LogP-7.81
Rot. Bonds2

About dipotassium;1,1-dimethoxyethane;carbonate

dipotassium;1,1-dimethoxyethane;carbonate (PubChem CID 174946253) has the molecular formula C5H10K2O5 and a molecular weight of 228.33 g/mol. Its IUPAC name is dipotassium;1,1-dimethoxyethane;carbonate.

Molecular Properties

Compound Namedipotassium;1,1-dimethoxyethane;carbonate
PubChem CID174946253
Molecular FormulaC5H10K2O5
Molecular Weight228.33 g/mol
Exact Mass227.98
IUPAC Namedipotassium;1,1-dimethoxyethane;carbonate
SMILESCOC(C)OC.O=C([O-])[O-].[K+].[K+]
InChIInChI=1S/C4H10O2.CH2O3.2K/c1-4(5-2)6-3;2-1(3)4;;/h4H,1-3H3;(H2,2,3,4);;/q;;2*+1/p-2
InChIKeyOXMCPBROHQFLNY-UHFFFAOYSA-L
XLogP-7.81
TPSA81.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.33
LogP ≤ 5-7.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1,1-dimethoxyethane chloride
CID 22648542
1,1-dimethoxyethane;hafnium
CID 159457910
1,1-dimethoxyethane;formic acid
CID 174931321
1,3-dibromopropan-2-one;1,1-dimethoxyethane
CID 87680521
zinc;1,1-dimethoxyethane;dichloride
CID 173213885
lithium;1,1-dimethoxyethane;hydride
CID 174450087
bis(1-methoxyethyl(trimethyl)azanium);oxalate
CID 87192786
1,1-dimethoxyethane;2-methylprop-2-enamide
CID 158750658
1,1-dimethoxyethane;ethenone
CID 87235267
1,1-dimethoxyethane;ethyl acetate;trihydrobromide
CID 173412257
lithium;dipotassium;methanolate;carbonate
CID 174805423
bismuth tris(2-hydroxy-2-methoxyacetate)
CID 22600203

Frequently Asked Questions

What is the IUPAC name of dipotassium;1,1-dimethoxyethane;carbonate?
The IUPAC name of dipotassium;1,1-dimethoxyethane;carbonate (CID 174946253) is dipotassium;1,1-dimethoxyethane;carbonate.
What is the SMILES notation for dipotassium;1,1-dimethoxyethane;carbonate?
The canonical SMILES for dipotassium;1,1-dimethoxyethane;carbonate is COC(C)OC.O=C([O-])[O-].[K+].[K+].
What is the InChIKey of dipotassium;1,1-dimethoxyethane;carbonate?
The InChIKey is OXMCPBROHQFLNY-UHFFFAOYSA-L. The full InChI is InChI=1S/C4H10O2.CH2O3.2K/c1-4(5-2)6-3;2-1(3)4;;/h4H,1-3H3;(H2,2,3,4);;/q;;2*+1/p-2.
What are the key properties of dipotassium;1,1-dimethoxyethane;carbonate?
dipotassium;1,1-dimethoxyethane;carbonate has a molecular weight of 228.33 g/mol, XLogP of -7.81, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for dipotassium;1,1-dimethoxyethane;carbonate is sourced from PubChem (CID 174946253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).