1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane

C11H24O3 — CID 89379260

IUPAC1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane
SMILESCCOCC(CC)(COC)COCC
InChIInChI=1S/C11H24O3/c1-5-11(8-12-4,9-13-6-2)10-14-7-3/h5-10H2,1-4H3
InChIKeyPMMFXWXPENICQZ-UHFFFAOYSA-N
MW204.31 g/mol
LogP2.10
Rot. Bonds9

About 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane

1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane (PubChem CID 89379260) has the molecular formula C11H24O3 and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane.

Molecular Properties

Compound Name1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane
PubChem CID89379260
Molecular FormulaC11H24O3
Molecular Weight204.31 g/mol
Exact Mass204.17
IUPAC Name1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane
SMILESCCOCC(CC)(COC)COCC
InChIInChI=1S/C11H24O3/c1-5-11(8-12-4,9-13-6-2)10-14-7-3/h5-10H2,1-4H3
InChIKeyPMMFXWXPENICQZ-UHFFFAOYSA-N
XLogP2.10
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane?
The IUPAC name of 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane (CID 89379260) is 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane.
What is the SMILES notation for 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane?
The canonical SMILES for 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane is CCOCC(CC)(COC)COCC.
What is the InChIKey of 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane?
The InChIKey is PMMFXWXPENICQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24O3/c1-5-11(8-12-4,9-13-6-2)10-14-7-3/h5-10H2,1-4H3.
What are the key properties of 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane?
1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane has a molecular weight of 204.31 g/mol, XLogP of 2.10, 9 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-2-(ethoxymethyl)-2-(methoxymethyl)butane is sourced from PubChem (CID 89379260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).