3-(1-methoxyethyl)oxolane

C7H14O2 — CID 142607646

IUPAC3-(1-methoxyethyl)oxolane
SMILESCOC(C)C1CCOC1
InChIInChI=1S/C7H14O2/c1-6(8-2)7-3-4-9-5-7/h6-7H,3-5H2,1-2H3
InChIKeyYIOYKVJGDIURQC-UHFFFAOYSA-N
MW130.19 g/mol
LogP1.06
Rot. Bonds2

About 3-(1-methoxyethyl)oxolane

3-(1-methoxyethyl)oxolane (PubChem CID 142607646) has the molecular formula C7H14O2 and a molecular weight of 130.19 g/mol. Its IUPAC name is 3-(1-methoxyethyl)oxolane.

Molecular Properties

Compound Name3-(1-methoxyethyl)oxolane
PubChem CID142607646
Molecular FormulaC7H14O2
Molecular Weight130.19 g/mol
Exact Mass130.10
IUPAC Name3-(1-methoxyethyl)oxolane
SMILESCOC(C)C1CCOC1
InChIInChI=1S/C7H14O2/c1-6(8-2)7-3-4-9-5-7/h6-7H,3-5H2,1-2H3
InChIKeyYIOYKVJGDIURQC-UHFFFAOYSA-N
XLogP1.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 51.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(1-methoxyethyl)oxolane?
The IUPAC name of 3-(1-methoxyethyl)oxolane (CID 142607646) is 3-(1-methoxyethyl)oxolane.
What is the SMILES notation for 3-(1-methoxyethyl)oxolane?
The canonical SMILES for 3-(1-methoxyethyl)oxolane is COC(C)C1CCOC1.
What is the InChIKey of 3-(1-methoxyethyl)oxolane?
The InChIKey is YIOYKVJGDIURQC-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14O2/c1-6(8-2)7-3-4-9-5-7/h6-7H,3-5H2,1-2H3.
What are the key properties of 3-(1-methoxyethyl)oxolane?
3-(1-methoxyethyl)oxolane has a molecular weight of 130.19 g/mol, XLogP of 1.06, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-methoxyethyl)oxolane is sourced from PubChem (CID 142607646), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).