3-(2,3-dihydrofuran-3-ylmethyl)oxane

C10H16O2 — CID 163749743

IUPAC3-(2,3-dihydrofuran-3-ylmethyl)oxane
SMILESC1=CC(CC2CCCOC2)CO1
InChIInChI=1S/C10H16O2/c1-2-9(7-11-4-1)6-10-3-5-12-8-10/h3,5,9-10H,1-2,4,6-8H2
InChIKeyLOZKZHPGYGTYQT-UHFFFAOYSA-N
MW168.24 g/mol
LogP1.96
Rot. Bonds2

About 3-(2,3-dihydrofuran-3-ylmethyl)oxane

3-(2,3-dihydrofuran-3-ylmethyl)oxane (PubChem CID 163749743) has the molecular formula C10H16O2 and a molecular weight of 168.24 g/mol. Its IUPAC name is 3-(2,3-dihydrofuran-3-ylmethyl)oxane.

Molecular Properties

Compound Name3-(2,3-dihydrofuran-3-ylmethyl)oxane
PubChem CID163749743
Molecular FormulaC10H16O2
Molecular Weight168.24 g/mol
Exact Mass168.12
IUPAC Name3-(2,3-dihydrofuran-3-ylmethyl)oxane
SMILESC1=CC(CC2CCCOC2)CO1
InChIInChI=1S/C10H16O2/c1-2-9(7-11-4-1)6-10-3-5-12-8-10/h3,5,9-10H,1-2,4,6-8H2
InChIKeyLOZKZHPGYGTYQT-UHFFFAOYSA-N
XLogP1.96
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.24
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(2,3-Dihydrofuran-2-yl)oxane
CID 90722436
3-[3-(Cyclopentylidenemethoxy)propyl]oxane
CID 176603781
3-[3-[(E)-prop-1-enoxy]propyl]oxane
CID 176604178
(5R,6R,8S)-6,8-dimethyl-1,10-dioxaspiro[4.5]dec-2-ene
CID 10654675

Frequently Asked Questions

What is the IUPAC name of 3-(2,3-dihydrofuran-3-ylmethyl)oxane?
The IUPAC name of 3-(2,3-dihydrofuran-3-ylmethyl)oxane (CID 163749743) is 3-(2,3-dihydrofuran-3-ylmethyl)oxane.
What is the SMILES notation for 3-(2,3-dihydrofuran-3-ylmethyl)oxane?
The canonical SMILES for 3-(2,3-dihydrofuran-3-ylmethyl)oxane is C1=CC(CC2CCCOC2)CO1.
What is the InChIKey of 3-(2,3-dihydrofuran-3-ylmethyl)oxane?
The InChIKey is LOZKZHPGYGTYQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16O2/c1-2-9(7-11-4-1)6-10-3-5-12-8-10/h3,5,9-10H,1-2,4,6-8H2.
What are the key properties of 3-(2,3-dihydrofuran-3-ylmethyl)oxane?
3-(2,3-dihydrofuran-3-ylmethyl)oxane has a molecular weight of 168.24 g/mol, XLogP of 1.96, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,3-dihydrofuran-3-ylmethyl)oxane is sourced from PubChem (CID 163749743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).