2-(2-ethylhexoxymethyl)oxolane

C13H26O2 — CID 19370724

IUPAC2-(2-ethylhexoxymethyl)oxolane
SMILESCCCCC(CC)COCC1CCCO1
InChIInChI=1S/C13H26O2/c1-3-5-7-12(4-2)10-14-11-13-8-6-9-15-13/h12-13H,3-11H2,1-2H3
InChIKeyDAVMAOWQLFUAIY-UHFFFAOYSA-N
MW214.35 g/mol
LogP3.40
Rot. Bonds8

About 2-(2-ethylhexoxymethyl)oxolane

2-(2-ethylhexoxymethyl)oxolane (PubChem CID 19370724) has the molecular formula C13H26O2 and a molecular weight of 214.35 g/mol. Its IUPAC name is 2-(2-ethylhexoxymethyl)oxolane.

Molecular Properties

Compound Name2-(2-ethylhexoxymethyl)oxolane
PubChem CID19370724
Molecular FormulaC13H26O2
Molecular Weight214.35 g/mol
Exact Mass214.19
IUPAC Name2-(2-ethylhexoxymethyl)oxolane
SMILESCCCCC(CC)COCC1CCCO1
InChIInChI=1S/C13H26O2/c1-3-5-7-12(4-2)10-14-11-13-8-6-9-15-13/h12-13H,3-11H2,1-2H3
InChIKeyDAVMAOWQLFUAIY-UHFFFAOYSA-N
XLogP3.40
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 53.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2-ethylhexoxymethyl)oxolane?
The IUPAC name of 2-(2-ethylhexoxymethyl)oxolane (CID 19370724) is 2-(2-ethylhexoxymethyl)oxolane.
What is the SMILES notation for 2-(2-ethylhexoxymethyl)oxolane?
The canonical SMILES for 2-(2-ethylhexoxymethyl)oxolane is CCCCC(CC)COCC1CCCO1.
What is the InChIKey of 2-(2-ethylhexoxymethyl)oxolane?
The InChIKey is DAVMAOWQLFUAIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26O2/c1-3-5-7-12(4-2)10-14-11-13-8-6-9-15-13/h12-13H,3-11H2,1-2H3.
What are the key properties of 2-(2-ethylhexoxymethyl)oxolane?
2-(2-ethylhexoxymethyl)oxolane has a molecular weight of 214.35 g/mol, XLogP of 3.40, 8 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethylhexoxymethyl)oxolane is sourced from PubChem (CID 19370724), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).