3-(oxolan-3-yl)oxolane

C8H14O2 — CID 5247057

IUPAC3-(oxolan-3-yl)oxolane
SMILESC1CC(C2CCOC2)CO1
InChIInChI=1S/C8H14O2/c1-3-9-5-7(1)8-2-4-10-6-8/h7-8H,1-6H2
InChIKeyLUTCQIQZNVJETQ-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.06
Rot. Bonds1

About 3-(oxolan-3-yl)oxolane

3-(oxolan-3-yl)oxolane (PubChem CID 5247057) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 3-(oxolan-3-yl)oxolane.

Molecular Properties

Compound Name3-(oxolan-3-yl)oxolane
PubChem CID5247057
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name3-(oxolan-3-yl)oxolane
SMILESC1CC(C2CCOC2)CO1
InChIInChI=1S/C8H14O2/c1-3-9-5-7(1)8-2-4-10-6-8/h7-8H,1-6H2
InChIKeyLUTCQIQZNVJETQ-UHFFFAOYSA-N
XLogP1.06
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
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-(oxolan-3-yl)oxolane?
The IUPAC name of 3-(oxolan-3-yl)oxolane (CID 5247057) is 3-(oxolan-3-yl)oxolane.
What is the SMILES notation for 3-(oxolan-3-yl)oxolane?
The canonical SMILES for 3-(oxolan-3-yl)oxolane is C1CC(C2CCOC2)CO1.
What is the InChIKey of 3-(oxolan-3-yl)oxolane?
The InChIKey is LUTCQIQZNVJETQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-3-9-5-7(1)8-2-4-10-6-8/h7-8H,1-6H2.
What are the key properties of 3-(oxolan-3-yl)oxolane?
3-(oxolan-3-yl)oxolane has a molecular weight of 142.20 g/mol, XLogP of 1.06, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(oxolan-3-yl)oxolane is sourced from PubChem (CID 5247057), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).