3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran

C12H18O3 — CID 70268691

IUPAC3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran
SMILESC1=CC(CCOCCC2C=COC2)CO1
InChIInChI=1S/C12H18O3/c1(11-3-7-14-9-11)5-13-6-2-12-4-8-15-10-12/h3-4,7-8,11-12H,1-2,5-6,9-10H2
InChIKeyVKOMGDSKJOIJMA-UHFFFAOYSA-N
MW210.27 g/mol
LogP2.10
Rot. Bonds6

About 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran

3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran (PubChem CID 70268691) has the molecular formula C12H18O3 and a molecular weight of 210.27 g/mol. Its IUPAC name is 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran.

Molecular Properties

Compound Name3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran
PubChem CID70268691
Molecular FormulaC12H18O3
Molecular Weight210.27 g/mol
Exact Mass210.13
IUPAC Name3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran
SMILESC1=CC(CCOCCC2C=COC2)CO1
InChIInChI=1S/C12H18O3/c1(11-3-7-14-9-11)5-13-6-2-12-4-8-15-10-12/h3-4,7-8,11-12H,1-2,5-6,9-10H2
InChIKeyVKOMGDSKJOIJMA-UHFFFAOYSA-N
XLogP2.10
TPSA27.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.27
LogP ≤ 52.10
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran?
The IUPAC name of 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran (CID 70268691) is 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran.
What is the SMILES notation for 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran?
The canonical SMILES for 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran is C1=CC(CCOCCC2C=COC2)CO1.
What is the InChIKey of 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran?
The InChIKey is VKOMGDSKJOIJMA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O3/c1(11-3-7-14-9-11)5-13-6-2-12-4-8-15-10-12/h3-4,7-8,11-12H,1-2,5-6,9-10H2.
What are the key properties of 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran?
3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran has a molecular weight of 210.27 g/mol, XLogP of 2.10, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[2-[2-(2,3-dihydrofuran-3-yl)ethoxy]ethyl]-2,3-dihydrofuran is sourced from PubChem (CID 70268691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).