3-[3-(oxolan-3-yl)propyl]oxolane

C11H20O2 — CID 21031371

IUPAC3-[3-(oxolan-3-yl)propyl]oxolane
SMILESC(CC1CCOC1)CC1CCOC1
InChIInChI=1S/C11H20O2/c1(2-10-4-6-12-8-10)3-11-5-7-13-9-11/h10-11H,1-9H2
InChIKeyWNMPIFKVSJEWHY-UHFFFAOYSA-N
MW184.28 g/mol
LogP2.23
Rot. Bonds4

About 3-[3-(oxolan-3-yl)propyl]oxolane

3-[3-(oxolan-3-yl)propyl]oxolane (PubChem CID 21031371) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is 3-[3-(oxolan-3-yl)propyl]oxolane.

Molecular Properties

Compound Name3-[3-(oxolan-3-yl)propyl]oxolane
PubChem CID21031371
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Name3-[3-(oxolan-3-yl)propyl]oxolane
SMILESC(CC1CCOC1)CC1CCOC1
InChIInChI=1S/C11H20O2/c1(2-10-4-6-12-8-10)3-11-5-7-13-9-11/h10-11H,1-9H2
InChIKeyWNMPIFKVSJEWHY-UHFFFAOYSA-N
XLogP2.23
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(oxolan-3-yl)propyl]oxolane?
The IUPAC name of 3-[3-(oxolan-3-yl)propyl]oxolane (CID 21031371) is 3-[3-(oxolan-3-yl)propyl]oxolane.
What is the SMILES notation for 3-[3-(oxolan-3-yl)propyl]oxolane?
The canonical SMILES for 3-[3-(oxolan-3-yl)propyl]oxolane is C(CC1CCOC1)CC1CCOC1.
What is the InChIKey of 3-[3-(oxolan-3-yl)propyl]oxolane?
The InChIKey is WNMPIFKVSJEWHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O2/c1(2-10-4-6-12-8-10)3-11-5-7-13-9-11/h10-11H,1-9H2.
What are the key properties of 3-[3-(oxolan-3-yl)propyl]oxolane?
3-[3-(oxolan-3-yl)propyl]oxolane has a molecular weight of 184.28 g/mol, XLogP of 2.23, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(oxolan-3-yl)propyl]oxolane is sourced from PubChem (CID 21031371), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).