2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan

C16H16O3 — CID 123596794

IUPAC2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan
SMILESC(=CC1CCC(C=Cc2ccco2)O1)c1ccco1
InChIInChI=1S/C16H16O3/c1-3-13(17-11-1)5-7-15-9-10-16(19-15)8-6-14-4-2-12-18-14/h1-8,11-12,15-16H,9-10H2
InChIKeySQWYBDXNRCKNDG-UHFFFAOYSA-N
MW256.30 g/mol
LogP4.15
Rot. Bonds4

About 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan

2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan (PubChem CID 123596794) has the molecular formula C16H16O3 and a molecular weight of 256.30 g/mol. Its IUPAC name is 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan.

Molecular Properties

Compound Name2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan
PubChem CID123596794
Molecular FormulaC16H16O3
Molecular Weight256.30 g/mol
Exact Mass256.11
IUPAC Name2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan
SMILESC(=CC1CCC(C=Cc2ccco2)O1)c1ccco1
InChIInChI=1S/C16H16O3/c1-3-13(17-11-1)5-7-15-9-10-16(19-15)8-6-14-4-2-12-18-14/h1-8,11-12,15-16H,9-10H2
InChIKeySQWYBDXNRCKNDG-UHFFFAOYSA-N
XLogP4.15
TPSA35.51 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.30
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan?
The IUPAC name of 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan (CID 123596794) is 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan.
What is the SMILES notation for 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan?
The canonical SMILES for 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan is C(=CC1CCC(C=Cc2ccco2)O1)c1ccco1.
What is the InChIKey of 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan?
The InChIKey is SQWYBDXNRCKNDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16O3/c1-3-13(17-11-1)5-7-15-9-10-16(19-15)8-6-14-4-2-12-18-14/h1-8,11-12,15-16H,9-10H2.
What are the key properties of 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan?
2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan has a molecular weight of 256.30 g/mol, XLogP of 4.15, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[5-[2-(furan-2-yl)ethenyl]oxolan-2-yl]ethenyl]furan is sourced from PubChem (CID 123596794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).