2-(2,2-diethoxyethoxy)-2-methylpropane

C10H22O3 — CID 63628405

IUPAC2-(2,2-diethoxyethoxy)-2-methylpropane
SMILESCCOC(COC(C)(C)C)OCC
InChIInChI=1S/C10H22O3/c1-6-11-9(12-7-2)8-13-10(3,4)5/h9H,6-8H2,1-5H3
InChIKeyNECRSDDAHAFNKW-UHFFFAOYSA-N
MW190.28 g/mol
LogP2.20
Rot. Bonds6

About 2-(2,2-diethoxyethoxy)-2-methylpropane

2-(2,2-diethoxyethoxy)-2-methylpropane (PubChem CID 63628405) has the molecular formula C10H22O3 and a molecular weight of 190.28 g/mol. Its IUPAC name is 2-(2,2-diethoxyethoxy)-2-methylpropane.

Molecular Properties

Compound Name2-(2,2-diethoxyethoxy)-2-methylpropane
PubChem CID63628405
Molecular FormulaC10H22O3
Molecular Weight190.28 g/mol
Exact Mass190.16
IUPAC Name2-(2,2-diethoxyethoxy)-2-methylpropane
SMILESCCOC(COC(C)(C)C)OCC
InChIInChI=1S/C10H22O3/c1-6-11-9(12-7-2)8-13-10(3,4)5/h9H,6-8H2,1-5H3
InChIKeyNECRSDDAHAFNKW-UHFFFAOYSA-N
XLogP2.20
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.28
LogP ≤ 52.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2-diethoxyethoxy)-2-methylpropane?
The IUPAC name of 2-(2,2-diethoxyethoxy)-2-methylpropane (CID 63628405) is 2-(2,2-diethoxyethoxy)-2-methylpropane.
What is the SMILES notation for 2-(2,2-diethoxyethoxy)-2-methylpropane?
The canonical SMILES for 2-(2,2-diethoxyethoxy)-2-methylpropane is CCOC(COC(C)(C)C)OCC.
What is the InChIKey of 2-(2,2-diethoxyethoxy)-2-methylpropane?
The InChIKey is NECRSDDAHAFNKW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22O3/c1-6-11-9(12-7-2)8-13-10(3,4)5/h9H,6-8H2,1-5H3.
What are the key properties of 2-(2,2-diethoxyethoxy)-2-methylpropane?
2-(2,2-diethoxyethoxy)-2-methylpropane has a molecular weight of 190.28 g/mol, XLogP of 2.20, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2-diethoxyethoxy)-2-methylpropane is sourced from PubChem (CID 63628405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).