2-(oxolan-3-yl)oxolane

C8H14O2 — CID 551257

IUPAC2-(oxolan-3-yl)oxolane
SMILESC1COC(C2CCOC2)C1
InChIInChI=1S/C8H14O2/c1-2-8(10-4-1)7-3-5-9-6-7/h7-8H,1-6H2
InChIKeyYJPHFZQDJAPXNX-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.20
Rot. Bonds1

About 2-(oxolan-3-yl)oxolane

2-(oxolan-3-yl)oxolane (PubChem CID 551257) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 2-(oxolan-3-yl)oxolane.

Molecular Properties

Compound Name2-(oxolan-3-yl)oxolane
PubChem CID551257
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name2-(oxolan-3-yl)oxolane
SMILESC1COC(C2CCOC2)C1
InChIInChI=1S/C8H14O2/c1-2-8(10-4-1)7-3-5-9-6-7/h7-8H,1-6H2
InChIKeyYJPHFZQDJAPXNX-UHFFFAOYSA-N
XLogP1.20
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 ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(oxolan-3-yl)oxolane?
The IUPAC name of 2-(oxolan-3-yl)oxolane (CID 551257) is 2-(oxolan-3-yl)oxolane.
What is the SMILES notation for 2-(oxolan-3-yl)oxolane?
The canonical SMILES for 2-(oxolan-3-yl)oxolane is C1COC(C2CCOC2)C1.
What is the InChIKey of 2-(oxolan-3-yl)oxolane?
The InChIKey is YJPHFZQDJAPXNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-2-8(10-4-1)7-3-5-9-6-7/h7-8H,1-6H2.
What are the key properties of 2-(oxolan-3-yl)oxolane?
2-(oxolan-3-yl)oxolane has a molecular weight of 142.20 g/mol, XLogP of 1.20, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxolan-3-yl)oxolane is sourced from PubChem (CID 551257), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).